SCHEMBL9439632

SCHEMBL9439632

CNC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 5/20 1.00
KIF11 P52732 1/20 0.44
MAPK1 P28482 1/20 0.42
TSHR P16473 3/20 0.41
ALDH1A1 P00352 3/20 0.41
LMNA P02545 1/20 0.41
CYP2D6 P10635 1/20 0.41
TAAR1 Q96RJ0 1/20 0.39
ALOX15 P16050 1/20 0.39
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38

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
Hydrochloric Acid SCHEMBL28999077 0.97 KCNN4 (0.94) KCNN4KIF11MAPK1TSHRALDH1A1
Water SCHEMBL28621007 0.97 KCNN4 (0.94) KCNN4KIF11MAPK1TSHRALDH1A1
SCHEMBL12993257 0.88 KCNN4 (0.77) KCNN4KIF11MAPK1TSHRALDH1A1
SCHEMBL27532133 0.86 KCNN4 (0.74) KCNN4KIF11MAPK1TSHRALDH1A1
SCHEMBL12149866 0.82 KCNN4 (0.68) KCNN4KIF11LMNA
SCHEMBL13539766 0.82 KCNN4 (0.68) KCNN4KIF11LMNA
SCHEMBL26063349 0.79 KCNN4 (0.64) KCNN4KIF11MAPK1TSHRALDH1A1
SCHEMBL23960170 0.78 KCNN4 (0.61) KCNN4KIF11MAPK1ALDH1A1LMNA
SCHEMBL29262767 0.78 KCNN4 (0.61) KCNN4KIF11MAPK1TSHRLMNA
SCHEMBL27884007 0.78 KCNN4 (0.61) KCNN4KIF11MAPK1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110669058-A Tricyclic quinolone carboxylic acid and preparation method thereof 江西农业大学 2020-01-10 CN claimed
EP-3151828-A1 SHORT CHAIN PEGYLATION OF AMINO ACID MONOMERS GLUTAMINE AND LYSINE AND PEPTIDES FORMED THEREBY Clemson University (US) 2017-04-12 EP claimed
WO-2015191433-A1 SHORT CHAIN PEGYLATION OF AMINO ACID MONOMERS GLUTAMINE AND LYSINE AND PEPTIDES FORMED THEREBY CLEMSON UNIVERSITY (US) 2015-12-17 WO claimed
WO-2024052333-A1 MULTIVALENT FIBROBLAST ACTIVATION PROTEIN LIGANDS FOR TARGETED DELIVERY APPLICATIONS PHILOCHEM AG (CH) 2024-03-14 WO disclosed
US-11718638-B2 Compounds, compositions and methods for synthesis WAVE LIFE SCIENCES LTD. (SG) 2023-08-08 US disclosed
EP-4115908-A1 EXON SKIPPING OLIGOMER CONJUGATES FOR MUSCULAR DYSTROPHY Sarepta Therapeutics, Inc. (US) 2023-01-11 EP disclosed
CN-115151553-A Boronic acid derivatives 首药控股(北京)股份有限公司 2022-10-04 CN disclosed
EP-4019507-A1 FIBROBLAST ACTIVATION PROTEIN LIGANDS FOR TARGETED DELIVERY APPLICATIONS Philochem AG (CH) 2022-06-29 EP disclosed
WO-2021160825-A1 FIBROBLAST ACTIVATION PROTEIN LIGANDS FOR TARGETED DELIVERY APPLICATIONS PHILOCHEM AG (CH) 2021-08-19 WO disclosed
WO-2020123574-A1 EXON SKIPPING OLIGOMER CONJUGATES FOR MUSCULAR DYSTROPHY SAREPTA THERAPEUTICS, INC. (US) 2020-06-18 WO disclosed
WO-2020023688-A1 EXON SKIPPING OLIGOMERS FOR MUSCULAR DYSTROPHY SAREPTA THERAPEUTICS, INC. (US) 2020-01-30 WO disclosed
US-20100291093-A1 ANTIBODY-MEDIATED DISRUPTION OF QUORUM SENSING IN BACTERIA THE SCRIPPS RESEARCH INSTITUTE (US) 2010-11-18 US disclosed
US-20100248264-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions HK PHARMACEUTICALS, INC. 2010-09-30 US disclosed
CN-101506948-A Dicing/die bonding film NITTO DENKO CORP (JP) 2009-08-12 CN disclosed
EP-1465880-B1 5-SULPHANYL-4H-1,2,4-TRIAZOLE DERIVATIVES AND THEIR USE TO TREAT DISORDERS ASSOCIATED WITH SOMATOSTATINE IPSEN PHARMA (FR) 2009-08-05 EP disclosed
CN-101385135-A Process for producing semiconductor device NIPPON ELECTRIC CO (JP) 2009-03-11 CN disclosed
CN-1129517-A Herbicides based on aryluracils for use in rice cultivation BAYER AG (DE) 1996-08-28 CN disclosed
US-5321032-A Peptide compounds and pharmaceutical compositions thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-06-14 US disclosed
EP-0515681-A1 PEPTIDE COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-12-02 EP disclosed
WO-1991000858-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS SCHERING CORPORATION (US) 1991-01-24 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 (2 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-11718638-B2 Compounds, compositions and methods for synthesis ALKBH1, DUT, RNGTT KCNN4 4130/4885KIF11 2775/4885MAPK1 4655/4885
US-20100291093-A1 ANTIBODY-MEDIATED DISRUPTION OF QUORUM SENSING IN BACTERIA CD47, BCR, TLR5 KCNN4 3499/4885KIF11 4440/4885MAPK1 685/4885

“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.