SCHEMBL7635015

SCHEMBL7635015

CCCC#CC1=CCC(C)(C)c2ccc(C#Cc3ccc(C(=O)O)cc3)cc21

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RARB P10826 19/20 0.61
RARG P13631 19/20 0.61
RARA P10276 18/20 0.61
CYP26A1 O43174 1/20 0.51
CYP3A4 P08684 1/20 0.51
CRABP2 P29373 1/20 0.51

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
SCHEMBL7638733 0.92 RARA (0.53) RARBRARGRARACYP26A1CYP3A4
SCHEMBL7633641 0.88 RARA (0.50) RARBRARGRARACYP26A1CYP3A4
SCHEMBL7806999 0.85 RARA (0.78) RARBRARGRARACYP26A1CYP3A4
SCHEMBL7640517 0.85 RARB (0.67) RARBRARGRARACYP26A1CYP3A4
SCHEMBL7157957 0.83 RARB (0.72) RARBRARGRARACYP26A1CYP3A4
SCHEMBL7637269 0.80 RARA (0.43) RARBRARGRARACYP26A1CYP3A4
SCHEMBL7633630 0.80 RARB (0.62) RARBRARGRARACYP26A1CYP3A4
SCHEMBL7642416 0.79 RARB (0.71) RARBRARGRARACYP26A1CYP3A4
SCHEMBL8901440 0.78 RARB (0.63) RARBRARGRARACYP26A1CYP3A4
SCHEMBL8772545 0.78 RARB (0.63) RARBRARGRARACYP26A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6355806-B1 REGULATORS OF CELL PROLIFERATION AND DIFFERENTIATION, AGENTS FOR TREATING SKIN-RELATED DISEASES ALLERGEN SALES, INC. 2002-03-12 US disclosed
US-5998471-A SKIN DISORDERS; ANTIINFLAMMATORY AGENTS ALLERGAN SALES, INC. (US) 1999-12-07 US disclosed
US-5808083-A Acetylenes disubstituted with a 5 alkyl, aryl or heteroaryl substituted dihydronaphthyl group and with an aryl or heteroaryl group having retinoid-like biological activity ALLERGAN (US) 1998-09-15 US disclosed
EP-0800517-A1 ACETYLENES DISUBSTITUTED WITH A 5 OR 8 SUBSTITUTED TETRAHYDRONAPHTHYL OR DIHYDRONAPHTHYL GROUP AND WITH AN ARYL OR HETEROARYL GROUPS HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY Allergan (US) 1997-10-15 EP disclosed
US-5648514-A Substituted acetylenes having retinoid-like biological activity ALLERGAN (US) 1997-07-15 US disclosed
WO-1996020930-A1 ACETYLENES DISUBSTITUTED WITH A 5 OR 8 SUBSTITUTED TETRAHYDRONAPHTHYL OR DIHYDRONAPHTHYL GROUP AND WITH AN ARYL OR HETEROARYL GROUPS HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY ALLERGAN (US) 1996-07-11 WO disclosed