SCHEMBL452845

SCHEMBL452845

O=C(O)CCCc1ccc(I)cc1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.67
HDAC3 O15379 1/20 0.67
MAPK1 P28482 1/20 0.67
ADRA1A P35348 1/20 0.67
HDAC4 P56524 1/20 0.67
SLC6A3 Q01959 1/20 0.67
HDAC1 Q13547 1/20 0.67
HDAC7 Q8WUI4 1/20 0.67
HDAC2 Q92769 1/20 0.67
HDAC10 Q969S8 1/20 0.67
HDAC11 Q96DB2 1/20 0.67
HDAC8 Q9BY41 1/20 0.67
HDAC6 Q9UBN7 1/20 0.67
HDAC9 Q9UKV0 1/20 0.67
HDAC5 Q9UQL6 1/20 0.67
HSD17B10 Q99714 1/20 0.61
FFAR1 O14842 4/20 0.58
MAPT P10636 2/20 0.57
RXFP1 Q9HBX9 1/20 0.57
RXRA P19793 1/20 0.54

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2197174 0.94 MAPT (0.66) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL25575670 0.92 MAPT (0.69) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL2835656 0.92 MAPT (0.69) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL9860436 0.92 MAPT (0.69) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
Iocanlidic Acid SCHEMBL290025 0.92 MAPT (0.69) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL29256339 0.91 MAPT (0.58) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL6208836 0.89 SMN1; SMN2 (0.82) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL1007160 0.87 FFAR1 (0.65) FFAR1LMNAKEAP1
SCHEMBL69789 0.87 SMN1; SMN2 (0.78) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
Iocanlidic Acid SCHEMBL27870026 0.86 MAPT (0.61) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 796 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260137821-A1 PEPTIDE STRUCTURE TARGETING CARBONIC DEHYDROGENASE IX AND USE THEREOF C-BIOMEX CO., LTD. (KR) 2026-05-21 US claimed
US-12486304-B2 Peptide ligand targeting carbonic anhydrase IX, peptide construct comprising same, and uses thereof C-BIOMEX CO., LTD. (KR) 2025-12-02 US claimed
EP-4652180-A2 PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR Janssen Pharmaceutica NV (BE) 2025-11-26 EP claimed
US-20250352498-A1 PHARMACEUTICAL FORMULATIONS CONTAINING PHENYLBUTYRATE AND METHODS THEREOF AARDVARK THERAPEUTICS INC. (US) 2025-11-20 US claimed
US-20250302981-A1 NOVEL USE OF ANTICANCER AGENT PRODRUG CONJUGATE UNIVERSITY OF ULSAN FOUNDATION FOR INDUSTRY COOPERATION (KR) 2025-10-02 US claimed
EP-4619043-A1 FIBROBLAST ACTIVATION PROTEIN TARGETED COMPOUNDS AND USE THEREOF Perspective Therapeutics, Inc. (US) 2025-09-24 EP claimed
US-20250222143-A1 TARGETED RADIOTHERANOSTICS BASED ON POLYAZAMACROCYCLIC, MIXED-DONOR SCAFFOLDS LINKED TO A TARGETING VECTOR THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2025-07-10 US claimed
WO-2025128149-A1 FIBROBLAST ACTIVATION PROTEIN TARGETED COMPOUNDS AND USE THEREOF VIEWPOINT MOLECULAR TARGETING, INC. (US) 2025-06-19 WO claimed
US-20250186630-A1 FIBROBLAST ACTIVATION PROTEIN TARGETING PEPTIDES VIEWPOINT MOLECULAR TARGETING, INC. (US) 2025-06-12 US claimed
CN-120118155-A PD-L1 targeted polypeptide positron probe and preparation method and application thereof 南方医科大学南方医院 2025-06-10 CN claimed
US-5843994-A Compositions and methods for treating and preventing pathologies including cancer THE UNITED STATES OF AMERICA AS REPRESENETED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1998-12-01 US claimed
US-5712307-A Methods of inducing the production of hemoglobin and treating pathologies associated with abnormal hemoglobin activity using phemylacetic acids and derivatives therof THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1998-01-27 US claimed
US-5710178-A ARYL- AND ARYLOXYALKANOIC ACIDS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1998-01-20 US claimed
US-5708025-A BY INDUCING PRODUCTION OF FETAL HEMOGLOBINS BY ADMINISTERING SPECIFIED ARYL ACIDS, DERIVATIVES, SALTS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1998-01-13 US claimed
US-5708171-A HISTAMINE H3-RECEPTOR ANTAGONIST INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1998-01-13 US claimed
US-5661179-A ADMINISTERING; TREATS NEUROBLASTOMA, MYELODYSPLASIA, NON-SMALL CELL LUNG CANCER, PROSTATE CANCER, MELANOMA, BRAIN TUMOR, KAPOSI'S SARCOMA, LYMPHOMA, LEUKEMIA, BREAST AND LUNG CANCER, OSTEOSARCOMA AND FIBROSARCOMA THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1997-08-26 US claimed
US-5654333-A THERAPY FOR ANEMIA, CANCER, AIDS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1997-08-05 US claimed
US-5635533-A ANTITUMOR AGENTS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1997-06-03 US claimed
US-5635532-A ADMINISTERING PHENYL OR NAPHTHYL ACETIC ACID DERIVATIVES THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1997-06-03 US claimed
US-5605930-A ADMINISTERING PHENYLACETIC ACID AS AN INHIBITOR OF THE MEVALONATE PATHWAY THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1997-02-25 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250302981-A1 NOVEL USE OF ANTICANCER AGENT PRODRUG CONJUGATE KRAS, TP53, NRAS SMN1; SMN2 3629/4885HDAC3 2769/4885MAPK1 1442/4885
US-20250352498-A1 PHARMACEUTICAL FORMULATIONS CONTAINING PHENYLBUTYRATE AND METHODS THEREOF ABAT, CPT1B, GABBR1 SMN1; SMN2 762/4885HDAC3 757/4885MAPK1 4494/4885
US-20250222143-A1 TARGETED RADIOTHERANOSTICS BASED ON POLYAZAMACROCYCLIC, MIXED-DONOR SCAFFOLDS LINKED TO A TARGETING VECTOR PAICS, RABGGTB, PARP1 SMN1; SMN2 3520/4885HDAC3 1275/4885MAPK1 4343/4885
US-12486304-B2 Peptide ligand targeting carbonic anhydrase IX, peptide construct comprising same, and uses thereof CA9, CA4, CA12 SMN1; SMN2 4080/4885HDAC3 3911/4885MAPK1 3293/4885
US-20250186630-A1 FIBROBLAST ACTIVATION PROTEIN TARGETING PEPTIDES FAP, FIBP, TPX2 SMN1; SMN2 3640/4885HDAC3 4414/4885MAPK1 2142/4885
US-20260137821-A1 PEPTIDE STRUCTURE TARGETING CARBONIC DEHYDROGENASE IX AND USE THEREOF CA5A, CA1, CA9 SMN1; SMN2 3004/4885HDAC3 656/4885MAPK1 4519/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.