SCHEMBL7583672

SCHEMBL7583672

COCOc1c(-c2ccccc2)ccc2c1C(C)(C)CCC2(C)C

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
RARG P13631 14/20 0.36
RARB P10826 5/20 0.36
RXRA P19793 1/20 0.36
RARA P10276 4/20 0.34
FYN P06241 1/20 0.31
ADRB2 P07550 1/20 0.31
PTPN1 P18031 1/20 0.31
CDC25A P30304 1/20 0.31
CDC25B P30305 1/20 0.31

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
SCHEMBL6472627 0.81 CYP26A1 (0.42) RARGRARBRXRARARA
SCHEMBL6472625 0.81 CYP26A1 (0.42) RARGRARBRXRARARA
SCHEMBL18969683 0.76 EGFR (0.44) EGFRTP53ADRB2PTPN1
SCHEMBL6473205 0.75 TP53 (0.42) TP53CYP1A2RARGRARBRARA
SCHEMBL5847404 0.73 RARG (0.69) RARGRARBRXRARARA
SCHEMBL6473259 0.72 TP53 (0.40) TP53CYP1A2RARGRARBRXRA
SCHEMBL26943123 0.72 RARB (0.41) TP53CYP1A2RARGRARBRXRA
SCHEMBL5846718 0.72 RARG (0.43) RARGRARBRXRARARA
SCHEMBL23421819 0.71 RARB (0.45) TP53CYP1A2RARGRARBRXRA
SCHEMBL5846349 0.70 RARG (0.44) RARGRARBRXRARARA

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-0947496-B1 Bicyclic aromatic compounds and their use in human and veterinary medicine as well as in cosmetology GALDERMA RES & DEV (FR) 2002-10-09 EP disclosed
EP-0947496-A1 Bicyclic aromatic compounds and their use in human and veterinary medicine as well as in cosmetology Galderma Research & Development, S.N.C. (FR) 1999-10-06 EP disclosed