SCHEMBL8674121

SCHEMBL8674121

CC1(C)CCC(C)(C)c2cc(SCc3ccc(C(=O)O)cc3)ccc21

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXRA P19793 15/20 0.69
RXRB P28702 11/20 0.69
RXRG P48443 8/20 0.69
RARB P10826 8/20 0.69
RARG P13631 8/20 0.69
RARA P10276 5/20 0.59
CYP26A1 O43174 2/20 0.57
CYP3A4 P08684 1/20 0.54
CRABP2 P29373 1/20 0.54

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
SCHEMBL15554765 0.88 RXRA (0.67) RXRARXRBRXRGRARBRARG
SCHEMBL7723487 0.82 RXRA (1.00) RXRARXRBRXRGRARBRARG
SCHEMBL8839140 0.82 RXRA (0.65) RXRARXRBRXRGRARBRARG
SCHEMBL9515841 0.81 RXRA (0.64) RXRARXRBRXRGRARBRARG
SCHEMBL9208986 0.79 RXRA (0.78) RXRARXRBRXRGRARBRARG
SCHEMBL8839257 0.79 RXRA (0.69) RXRARXRBRXRGRARBRARG
SCHEMBL9526508 0.79 RXRA (0.65) RXRARXRBRXRGRARBRARG
SCHEMBL14286039 0.77 CYP26B1 (0.70) RXRARXRBRXRGRARBRARG
SCHEMBL9318594 0.77 RXRA (0.70) RXRARXRBRXRGRARBRARG
SCHEMBL8460878 0.77 RXRA (0.70) RXRARXRBRXRGRARBRARG

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
US-5739374-A Processes of preparing diphenylheteroalkyl derivatives BASF AKTIENGESELLSCHAFT (DE) 1998-04-14 US disclosed
US-5656619-A Diphenylheteroalkyl derivatives, the preparation thereof and drugs and cosmetics prepared therefrom BASF AKTIENGESELLSCHAFT (DE) 1997-08-12 US disclosed
US-5527945-A Diphenylheteroalkyl derivatives, the preparation thereof and drugs and cosmetics prepared therefrom BASF AKTIENGESELLSCHAFT (DE) 1996-06-18 US disclosed
US-5248823-A Diphenylheteroalkyl derivatives, the preparation thereof and drugs and cosmetics prepared therefrom BASF AKTIENGESELLSCHAFT (DE) 1993-09-28 US disclosed
EP-0386452-B1 DIPHENYL HETEROALKYL DERIVATIVES, THEIR PREPARATION AND MEDICINAL AND COSMETIC PREPARATIONS PREPARED THEREFROM BASF Aktiengesellschaft (DE) 1993-09-22 EP disclosed
US-5225601-A Sulfur containing compounds for skin disorders BASF AKTIENGESELLSCHAFT (DE) 1993-07-06 US disclosed
EP-0386452-A1 Diphenyl heteroalkyl derivatives, their preparation and medicinal and cosmetic preparations prepared therefrom BASF Aktiengesellschaft (DE) 1990-09-12 EP disclosed