SCHEMBL7563153

SCHEMBL7563153

COCC(=O)Cc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 3/20 0.55
NR3C1 P04150 1/20 0.52
FFAR1 O14842 2/20 0.51
LTA4H P09960 2/20 0.50
EPHX2 P34913 2/20 0.49
ALDH1A1 P00352 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
NPY5R Q15761 1/20 0.47
HPGD P15428 1/20 0.46
PPARG P37231 1/20 0.46
PPARD Q03181 1/20 0.46
PPARA Q07869 1/20 0.46

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
SCHEMBL3628816 0.86 CES1 (0.52) ALDH1A1SMN1; SMN2
SCHEMBL9571882 0.83 ALOX5 (0.62) FFAR1ALDH1A1CYP1A2CYP2C19SMN1; SMN2
SCHEMBL8867104 0.82 HTT (0.59) ALDH1A1CYP2C19SMN1; SMN2
SCHEMBL1594428 0.79 SRD5A2 (0.58) SRD5A2NR3C1FFAR1LTA4HEPHX2
SCHEMBL3192546 0.79 SRD5A2 (0.58) SRD5A2NR3C1FFAR1LTA4HEPHX2
SCHEMBL28159713 0.79 SRD5A2 (0.63) SRD5A2NR3C1FFAR1LTA4HEPHX2
SCHEMBL850542 0.79 SRD5A2 (0.62) SRD5A2NR3C1FFAR1LTA4HEPHX2
SCHEMBL5953992 0.79 SRD5A2 (0.54) SRD5A2NR3C1FFAR1LTA4HEPHX2
SCHEMBL12259199 0.78 FFAR1 (0.62) SRD5A2FFAR1LTA4HEPHX2ALDH1A1
SCHEMBL1145770 0.78 SRD5A2 (0.83) SRD5A2NR3C1FFAR1LTA4H

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-0882703-B1 CYCLIC AMIC ACID DERIVATIVES BANYU PHARMA CO LTD (JP) 2002-08-14 EP disclosed
US-6011174-A INHIBIT PROTEIN-FARNESYL TRANSFERASE (PFT) IN VIVO THEREBY TO SUPPRESS FUNCTION OF ONCOGENE PROTEIN RAS AND THUS PRESENT ANTITUMOR ACTIVITIES, BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-01-04 US disclosed
EP-0882703-A1 CYCLIC AMIC ACID DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-12-09 EP disclosed