SCHEMBL7808934

SCHEMBL7808934

CC1(C)CCC(C)(C)c2cc3c(cc21)OCC3(C)c1ccc(C(=O)O)cc1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXRA P19793 20/20 0.58
NR4A2 P43354 3/20 0.55
RXRB P28702 8/20 0.54
RXRG P48443 5/20 0.54
CYP26A1 O43174 2/20 0.53
CYP26B1 Q9NR63 2/20 0.53
RARB P10826 3/20 0.51
RARG P13631 3/20 0.51
RARA P10276 2/20 0.49

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
SCHEMBL6729166 0.85 RXRA (0.59) RXRARXRBRXRGCYP26A1CYP26B1
SCHEMBL6730217 0.84 RXRA (0.57) RXRARXRBRXRGCYP26A1CYP26B1
SCHEMBL7803730 0.83 RARA (0.46) RXRANR4A2RXRBRXRGRARB
SCHEMBL7803727 0.81 RXRA (0.46) RXRANR4A2RXRBRXRGRARB
SCHEMBL7801892 0.79 RXRA (0.58) RXRANR4A2RXRBRXRGCYP26A1
SCHEMBL7812219 0.79 RXRA (0.43) RXRANR4A2RXRBRXRGRARB
SCHEMBL8592924 0.79 RARA (0.40) RXRANR4A2RXRBRXRGCYP26A1
SCHEMBL6734814 0.79 RXRA (0.58) RXRANR4A2RXRBRXRGCYP26A1
SCHEMBL20876244 0.77 BRD4 (0.52) RXRACYP26A1CYP26B1RARBRARG
SCHEMBL7799673 0.76 RXRA (0.50) RXRARXRBRXRGCYP26A1CYP26B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0816352-B1 Bi-aryl heterocyclic compounds and their use in human or veterinary medicine and in cosmetics CT INTERNAT DE (FR) 2001-02-21 EP claimed
US-5905088-A SKIN DISORDERS, RHEUMATIC DISEASES, RESPIRATORY SYSTEM OR CARDIOVASCULAR DISORDERS AND OPTHALMOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1999-05-18 US claimed
EP-0816352-B1 Bi-aryl heterocyclic compounds and their use in human or veterinary medicine and in cosmetics CT INTERNAT DE (FR) 2001-02-21 EP disclosed
US-5905088-A SKIN DISORDERS, RHEUMATIC DISEASES, RESPIRATORY SYSTEM OR CARDIOVASCULAR DISORDERS AND OPTHALMOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1999-05-18 US disclosed
EP-0816352-A1 Bi-aryl heterocyclic compounds and their use in human or veterinary medicine and in cosmetics CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1998-01-07 EP disclosed