SCHEMBL10522348

SCHEMBL10522348

CCc1ccccc1C(C(=O)O)(C(=O)O)c1ccccc1CC

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.46
GABRB2 P47870 2/20 0.46
ALDH1A1 P00352 2/20 0.40
MAPT P10636 1/20 0.40
POLQ O75417 1/20 0.39
CLCN2 P51788 1/20 0.39
POLB P06746 2/20 0.38
MAPK1 P28482 1/20 0.38
AKR1B1 P15121 1/20 0.38
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36

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
SCHEMBL2964988 0.82 GABRA1 (0.45) GABRA1GABRB2ALDH1A1MAPTPOLQ
SCHEMBL10218791 0.82 GABRA1 (0.45) GABRA1GABRB2ALDH1A1MAPTPOLQ
SCHEMBL10448955 0.82 GABRA1 (0.45) GABRA1GABRB2ALDH1A1MAPTPOLQ
SCHEMBL7192004 0.80 GABRA1 (0.43) GABRA1GABRB2ALDH1A1MAPTPOLQ
SCHEMBL20592727 0.80 POLQ (0.44) GABRA1GABRB2ALDH1A1MAPTPOLQ
SCHEMBL30335199 0.79 KCNN4 (0.44) GABRA1GABRB2ALDH1A1MAPTPOLQ
Hydrogen Peroxide SCHEMBL11570368 0.78 GABRA1 (0.50) GABRA1GABRB2ALDH1A1MAPTPOLB
SCHEMBL20564736 0.77 HIF1A (0.43) GABRA1GABRB2ALDH1A1MAPTPOLQ
SCHEMBL28044647 0.77 CYP2C9 (0.52) GABRA1GABRB2ALDH1A1MAPTPOLB
SCHEMBL9556057 0.76 GABRA1 (0.39) GABRA1GABRB2ALDH1A1MAPTPOLQ

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3625283-B1 POLYESTER COPOLYMER AVANTIUM KNOWLEDGE CENTRE BV (NL) 2025-05-07 EP disclosed
US-11548980-B2 Polyester copolymer AVANTIUM KNOWLEDGE CENTRE B.V. (NL) 2023-01-10 US disclosed
US-20210139645-A1 Polyester Copolymer AVANTIUM KNOWLEDGE CENTRE B.V. (NL) 2021-05-13 US disclosed
EP-3625283-A1 POLYESTER COPOLYMER Avantium Knowledge Centre B.V. (NL) 2020-03-25 EP disclosed
WO-2018211132-A1 POLYESTER COPOLYMER AVANTIUM KNOWLEDGE CENTRE B.V. (NL) 2018-11-22 WO disclosed
US-4863904-A Dipeptides as renin inhibitors KISSEI PHARMACEUTICAL CO., LTD. (JP) 1989-09-05 US disclosed
EP-0181110-A2 Histidine derivatives as renin inhibitors Kissei Pharmaceutical Co. Ltd. (JP) 1986-05-14 EP disclosed