SCHEMBL29370584

SCHEMBL29370584

CNCc1cccc(OC)c1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 2/20 0.68
▸ CHRM1 P11229 1/20 0.68
▸ CHRM3 P20309 1/20 0.68
▸ ALDH1A1 P00352 3/20 0.58
▸ HTT P42858 2/20 0.57
▸ SMN1; SMN2 Q16637 2/20 0.57
▸ MMP13 P45452 1/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ TAAR1 Q96RJ0 3/20 0.56
▸ IDO1 P14902 2/20 0.56
▸ AGXT P21549 2/20 0.56
▸ HTR7 P34969 1/20 0.54
▸ ABCB1 P08183 1/20 0.54
▸ ABCG2 Q9UNQ0 1/20 0.54
▸ KDM4E B2RXH2 1/20 0.53
▸ MAPT P10636 1/20 0.53

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
SCHEMBL297410 1.00 CHRM2 (0.68) CHRM2CHRM1CHRM3ALDH1A1HTT
SCHEMBL24061764 0.93 CHRM2 (0.60) CHRM2CHRM1CHRM3ALDH1A1HTT
SCHEMBL12993229 0.89 HTR7 (0.60) CHRM2CHRM1CHRM3ALDH1A1HTT
SCHEMBL13948896 0.88 ALDH1A1 (0.70) CHRM2CHRM1CHRM3ALDH1A1HTT
SCHEMBL1134127 0.86 CHRM2 (0.74) CHRM2CHRM1CHRM3ALDH1A1HTT
SCHEMBL18685365 0.84 CHRM2 (0.62) CHRM2CHRM1CHRM3ALDH1A1HTT
SCHEMBL7738530 0.84 CHRM2 (0.62) CHRM2CHRM1CHRM3ALDH1A1HTT
SCHEMBL27962852 0.84 CHRM2 (0.62) CHRM2CHRM1CHRM3ALDH1A1HTT
Hydrochloric Acid SCHEMBL6122475 0.84 CHRM2 (0.72) CHRM2CHRM1CHRM3ALDH1A1HTT
SCHEMBL2099512 0.83 CHRM2 (0.66) CHRM2CHRM1CHRM3TAAR1IDO1

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4612131-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2025-09-10 — — EP disclosed
CN-119816491-A New spirocyclohexane derivatives, pharmaceutical compositions containing them and their use as anti-apoptotic inhibitors 法国施维雅药厂 2025-04-11 — — CN disclosed
CN-118382614-A Novel benzyl tryptamine compounds 瑞安神经科学公司 2024-07-23 — — CN disclosed
WO-2024095003-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2024-05-10 — — WO disclosed
CN-116829558-A Compounds of formula (I) 艾斯法姆生物技术股份有限公司 2023-09-29 — — CN disclosed
EP-4188933-A1 COMPOUNDS Esfam Biotech Pty Ltd. (AU) 2023-06-07 — — EP disclosed
CN-114450277-A Substituted pyrimidines for the treatment and prevention of hepatitis B virus infection 豪夫迈·罗氏有限公司 2022-05-06 — — CN disclosed
WO-2022020888-A1 COMPOUNDS Esfam Biotech Pty Ltd (AU) 2022-02-03 — — WO disclosed
WO-2022020889-A1 METHOD OF TREATMENT OF CYTOMEGALOVIRUS Esfam Biotech Pty Ltd (AU) 2022-02-03 — — WO disclosed
WO-2022020890-A1 TREATMENT OF VETERINARY CONDITIONS ASSOCIATED WITH CD151 Esfam Biotech Pty Ltd (AU) 2022-02-03 — — WO disclosed
WO-2022020887-A1 TREATMENT OF CD151 RELATED DISORDERS Esfam Biotech Pty Ltd (AU) 2022-02-03 — — WO disclosed
WO-2022020891-A1 METHODS OF PROPHYLAXIS AND TREATMENT OF CORONA VIRUS Esfam Biotech Pty Ltd (AU) 2022-02-03 — — WO disclosed
Send feedback