SCHEMBL23906982

SCHEMBL23906982

COC(=O)c1ccc(C(=O)O)cc1CBr

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 13/20 0.47
ALDH1A1 P00352 9/20 0.47
HPGD P15428 4/20 0.46
HSD17B10 Q99714 4/20 0.46
MAPT P10636 3/20 0.46
ATM Q13315 3/20 0.46
GLA P06280 2/20 0.46
GAA P10253 2/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
LMNA P02545 3/20 0.43
KDM6B O15054 1/20 0.43
KDM5C P41229 1/20 0.43
KDM4C Q9H3R0 1/20 0.43
KDM2A Q9Y2K7 1/20 0.43
KDM3A Q9Y4C1 1/20 0.43
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA7 P43166 2/20 0.42

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
SCHEMBL11601201 0.90 KDM4E (0.57) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL30832832 0.90 KDM4E (0.57) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL29192895 0.87 KDM4E (0.43) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL15568228 0.87 KDM4E (0.51) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL11622125 0.84 HRH3 (0.48) KDM4EALDH1A1HSD17B10MAPTLMNA
SCHEMBL28180523 0.84 KDM4E (0.48) KDM4EALDH1A1HSD17B10MAPTGAA
SCHEMBL23907027 0.84 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL9062685 0.83 NPC1 (0.48) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL28881046 0.83 KDM4E (0.48) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL9079991 0.83 PDGFRB (0.48) KDM4EALDH1A1HPGDHSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107383079-B Metal organic framework material based on alkyl mercaptan modification and synthetic method thereof 广东工业大学 2020-06-09 CN claimed
CN-111315735-B Dihydrobenzimidazolone C4医药公司 2024-03-08 CN disclosed
WO-2021198883-A1 SYNTHESIS OF OLIGONUCLEOTIDES AND RELATED COMPOUNDS Janssen Biopharma, Inc. (US) 2021-10-07 WO disclosed
CN-111315735-A Dihydrobenzimidazolones C4医药公司 2020-06-19 CN disclosed
CN-107383079-B Metal organic framework material based on alkyl mercaptan modification and synthetic method thereof 广东工业大学 2020-06-09 CN disclosed