SCHEMBL8499007

SCHEMBL8499007

CCC(=O)Oc1ccc(O)cc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFD P00746 2/20 0.47
CA12 O43570 3/20 0.47
CA1 P00915 3/20 0.47
CA2 P00918 3/20 0.47
CA7 P43166 3/20 0.47
CA9 Q16790 3/20 0.47
CA14 Q9ULX7 3/20 0.47
ALOX5 P09917 1/20 0.47
PTGS2 P35354 1/20 0.47
ALOX15 P16050 2/20 0.46
KDM4E B2RXH2 5/20 0.45
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
RECQL P46063 1/20 0.45
MYC P01106 1/20 0.45
PTPN1 P18031 1/20 0.45
ALDH1A1 P00352 4/20 0.43
TSHR P16473 2/20 0.43
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43

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
SCHEMBL11563537 0.83 CSNK2A1 (0.49) CFDALOX15KDM4EKMT2AMEN1
SCHEMBL11322926 0.83 ESR1 (0.50) CFDALOX15KDM4EKMT2AMEN1
SCHEMBL29140469 0.82 HSD17B10 (0.50) CFDALOX15KDM4EKMT2AMEN1
SCHEMBL3958391 0.82 ALDH1A1 (0.50) CFDALOX5PTGS2ALOX15KDM4E
SCHEMBL11564248 0.82 CFD (0.58) CFDALOX15KDM4EKMT2AMEN1
SCHEMBL28169742 0.81 ALOX15 (0.50) CA12CA1CA2CA7CA9
SCHEMBL344489 0.81 CFD (0.71) CFDCA12CA1CA2CA7
SCHEMBL28213139 0.81 ALOX15 (0.48) CFDALOX15KDM4EKMT2AMEN1
SCHEMBL9573599 0.80 CA12 (0.55) CFDCA12CA1CA2CA7
SCHEMBL7902296 0.79 TSHR (0.57) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0955032-A1 COSMETIC Technoble Co., Ltd. (JP) 1999-11-10 EP claimed
CN-1219118-A Cosmetic TECHNOBLE CO LTD (JP) 1999-06-09 CN claimed