SCHEMBL28989735

SCHEMBL28989735

Cc1cc(-c2ccccc2C(=O)O)n(-c2nc(C)c(C)nc2C)n1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.43
▸ TSHR P16473 2/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ USP2 O75604 1/20 0.43
▸ FTO Q9C0B1 1/20 0.40
▸ MYC P01106 1/20 0.39
▸ HPGD P15428 2/20 0.39
▸ CA12 O43570 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ CA9 Q16790 2/20 0.39
▸ GFER P55789 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ NTRK1 P04629 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL28988946 0.84 ALDH1A1 (0.45) ALDH1A1TSHRKDM4EUSP2FTO
SCHEMBL28988944 0.84 ALDH1A1 (0.36) ALDH1A1KDM4EHPGDCA12CA2
SCHEMBL28988942 0.81 KDM4E (0.47) ALDH1A1TSHRKDM4EFTOMYC
SCHEMBL30396306 0.70 KMT2A (0.52) ALDH1A1TSHRL3MBTL1MAPTMEN1
SCHEMBL28988936 0.70 HSD17B10 (0.47) ALDH1A1TSHRKDM4EHPGDNPC1
SCHEMBL8560028 0.69 PIK3CG (0.49) ALDH1A1TSHRKDM4EUSP2MYC
SCHEMBL31590862 0.68 ALDH1A1 (0.45) ALDH1A1USP2HPGDNPC1RAB9A
SCHEMBL24733697 0.67 CYP1A2 (0.57) ALDH1A1TSHRFTOMYCCA12
SCHEMBL31681889 0.67 LMNA (0.38) ALDH1A1TSHRKDM4EHPGDL3MBTL1
SCHEMBL28988940 0.67 LMNA (0.38) ALDH1A1TSHRKDM4EHPGDL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4613744-A1 HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF Guangdong Zhongke Medicine Research Ltd. (CN) 2025-09-10 — — EP disclosed
CN-115991698-B Heterocyclic compound and preparation method and application thereof 广东中科药物研究有限公司 2024-03-29 — — CN disclosed
CN-115991698-A Heterocyclic compound and preparation method and application thereof 广东中科药物研究有限公司 2023-04-21 — — CN disclosed
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