SCHEMBL268920

SCHEMBL268920

NC1(C(=O)O)CCC2CC=CC=C2C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 9/20 0.37
CYP1A2 P05177 3/20 0.37
CYP2C19 P33261 3/20 0.37
GRM2 Q14416 2/20 0.37
GRM3 Q14832 2/20 0.37
ALOX15 P16050 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
GRM8 O00222 2/20 0.37
GRM6 O15303 2/20 0.37
LMNA P02545 1/20 0.37
GRM5 P41594 1/20 0.37
MTOR P42345 1/20 0.37
GRM1 Q13255 1/20 0.37
PLCB1 Q9NQ66 1/20 0.37
TSHR P16473 1/20 0.37
ALDH1A1 P00352 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL5586474 0.80
SCHEMBL9246797 0.74
SCHEMBL14842846 0.70
SCHEMBL27476502 0.64 AKR1C3 (0.30)
SCHEMBL4600001 0.64 AKR1C3 (0.44) GRM4CYP1A2CYP2C19GRM2GRM3
SCHEMBL14117526 0.64 AKR1C3 (0.44) GRM4CYP1A2CYP2C19GRM2GRM3
Acetic Acid SCHEMBL1666951 0.63 CHRNB2 (0.30)
SCHEMBL14117545 0.62 ESR2 (0.56) CYP2C9
SCHEMBL4600699 0.62 ESR2 (0.56) CYP2C9
SCHEMBL10922111 0.61 QDPR (0.40) ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6338945-B1 CONCURRENT SCREENING OF OLIGOPEPTIDE LIBRARIES SYNTHESIZED ON SOLID PHASE SUPPORTS TO ISOLATE BIOACTIVE MOLECULES WHICH ELICIT CYTOLYTIC ACTIVITY GENZYME CORPORATION 2002-01-15 US claimed
US-12528849-B2 WT1 HLA class II-binding peptides and compositions and methods comprising same MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2026-01-20 US disclosed
US-20250186563-A1 UNIT DOSE FORMULATION OF ANTIDOTES FOR FACTOR XA INHIBITORS AND METHODS OF USING THE SAME ALEXION PHARMA INC (US) 2025-06-12 US disclosed
EP-3604510-B1 ANTIDOTES FOR FACTOR XA INHIBITORS AND METHODS OF USING THE SAME ALEXION PHARMA INC (US) 2025-03-26 EP disclosed
US-20250092380-A1 ANTIDOTES TO FACTOR XA INHIBITORS ALEXION PHARMA INC (US) 2025-03-20 US disclosed
US-12195774-B2 Antidotes to factor XA inhibitors ALEXION PHARMACEUTICALS, INC. (US) 2025-01-14 US disclosed
US-20240408197-A1 METHODS AND COMPOSITIONS FOR TREATING CANCER MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2024-12-12 US disclosed
US-20240368220-A1 IMMUNOGENIC WT-1 PEPTIDES AND METHODS OF USE THEREOF MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2024-11-07 US disclosed
US-20240189401-A1 UNIT DOSE FORMULATION OF ANTIDOTES FOR FACTOR XA INHIBITORS AND METHODS OF USING THE SAME ALEXION PHARMA INC (US) 2024-06-13 US disclosed
US-20240082367-A1 ANTIDOTES FOR FACTOR XA INHIBITORS AND METHODS OF USING THE SAME ALEXION PHARMA INC (US) 2024-03-14 US disclosed
WO-1997035035-A1 A METHOD FOR IDENTIFYING CYTOTOXIC T-CELL EPITOPES NICOLETTE CHARLES (US) 1997-09-25 WO disclosed
US-5650489-A SOLID PHASE SYNTHESIS OF PEPTIDES, RANDOM SEQUENCES, COMBINATORIAL CHEMISTRY THE ARIZONA BOARD OF REGENTS (US) 1997-07-22 US disclosed
US-5510240-A Method of screening a peptide library THE ARIZONA BOARD OF REGENTS (US) 1996-04-23 US disclosed
EP-0705279-A1 TOPOLOGICALLY SEGREGATED, ENCODED SOLID PHASE LIBRARIES SELECTIDE CORPORATION (US) 1996-04-10 EP disclosed
US-5470753-A Peptide sequencing using mass spectrometry SELECTIDE CORPORATION (US) 1995-11-28 US disclosed
WO-1994028028-A1 TOPOLOGICALLY SEGREGATED, ENCODED SOLID PHASE LIBRARIES SELECTIDE CORPORATION (US) 1994-12-08 WO disclosed
WO-1994006017-A1 PEPTIDE SEQUENCING USING MASS SPECTROMETRY SELECTIDE CORPORATION (US) 1994-03-17 WO disclosed
EP-0542770-A4 RANDOM BIO-OLIGOMER LIBRARY, A METHOD OF SYNTHESIS THEREOF, AND A METHOD OF USE THEREOF 1993-09-15 EP disclosed
EP-0542770-A1 RANDOM BIO-OLIGOMER LIBRARY, A METHOD OF SYNTHESIS THEREOF, AND A METHOD OF USE THEREOF ARIZONA BOARD OF REGENTS a body corporate acting on behalf of Arizona State University (US) 1993-05-26 EP disclosed
WO-1992000091-A1 RANDOM BIO-OLIGOMER LIBRARY, A METHOD OF SYNTHESIS THEREOF, AND A METHOD OF USE THEREOF BIOLIGAND, INC. (US) 1992-01-09 WO disclosed

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-20240189401-A1 UNIT DOSE FORMULATION OF ANTIDOTES FOR FACTOR XA INHIBITORS AND METHODS OF USING THE SAME SERPINC1, F8, F9 GRM4 4525/4885CYP1A2 531/4885CYP2C19 374/4885
US-20250092380-A1 ANTIDOTES TO FACTOR XA INHIBITORS SERPINC1, F2, F8 GRM4 4774/4885CYP1A2 1414/4885CYP2C19 1438/4885
US-20250186563-A1 UNIT DOSE FORMULATION OF ANTIDOTES FOR FACTOR XA INHIBITORS AND METHODS OF USING THE SAME SERPINC1, F8, F9 GRM4 4525/4885CYP1A2 531/4885CYP2C19 374/4885
US-12195774-B2 Antidotes to factor XA inhibitors SERPINC1, F2, F8 GRM4 4774/4885CYP1A2 1414/4885CYP2C19 1438/4885
US-20240082367-A1 ANTIDOTES FOR FACTOR XA INHIBITORS AND METHODS OF USING THE SAME SERPINC1, F13B, F2 GRM4 4658/4885CYP1A2 1966/4885CYP2C19 1928/4885
US-12528849-B2 WT1 HLA class II-binding peptides and compositions and methods comprising same MICA, HLA-DRB1, TAP2 GRM4 4591/4885CYP1A2 4595/4885CYP2C19 3977/4885

“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.