SCHEMBL7881502

SCHEMBL7881502

CCCCCC/C=C(/C(=O)Cl)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 11/20 0.44
RXRB P28702 8/20 0.44
RXRG P48443 6/20 0.44
RARB P10826 11/20 0.44
RARG P13631 10/20 0.44
RARA P10276 9/20 0.42
CYP26A1 O43174 5/20 0.42
CYP3A4 P08684 4/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 2/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
GMNN O75496 1/20 0.42
USP2 O75604 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
POLB P06746 1/20 0.42
CYP2D6 P10635 1/20 0.42
NFKB1 P19838 1/20 0.42

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
SCHEMBL7881506 1.00 RXRA (0.44) RXRARXRBRXRGRARBRARG
SCHEMBL7884577 0.89 RXRA (0.48) RXRARXRBRXRGRARBRARG
SCHEMBL7884592 0.89 RXRA (0.48) RXRARXRBRXRGRARBRARG
SCHEMBL7884579 0.89 RXRA (0.48) RXRARXRBRXRGRARBRARG
SCHEMBL7884588 0.89 RXRA (0.48) RXRARXRBRXRGRARBRARG
SCHEMBL8773711 0.82 RXRA (0.42) RXRARXRBRXRGRARBRARG
SCHEMBL8773649 0.82 RXRA (0.42) RXRARXRBRXRGRARBRARG
SCHEMBL8773652 0.82 RXRA (0.42) RXRARXRBRXRGRARBRARG
SCHEMBL8773712 0.82 RXRA (0.42) RXRARXRBRXRGRARBRARG
SCHEMBL7876893 0.81 RARB (0.57) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6171603-B1 TREATING SKIN, HAIR, CARDIOVASCULAR, AUTOIMMUNE AND VISION DISORDERS; ADMINISTERING AS ANTICARCINOGENIC, ANTIDEPRESSANT,ANTIINFLAMMATORY, AND ANTIACNE AGENTS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2001-01-09 US disclosed
US-5935585-A Biaromatic amido compounds and pharmaceutical/cosmetic compositions comprised thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1999-08-10 US disclosed