SCHEMBL6928615

SCHEMBL6928615

CCCOC(=Cc1cccc(-c2cc3c(cc2C)C(C)(C)CCC3(C)C)c1)C(=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXRA P19793 11/20 0.43
RXRG P48443 7/20 0.43
RXRB P28702 5/20 0.43
RARG P13631 5/20 0.39
RARB P10826 4/20 0.38
BACE1 P56817 1/20 0.37
GLO1 Q04760 1/20 0.36
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
RARA P10276 4/20 0.35
MAPT P10636 1/20 0.35
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL6925549 0.93 RXRA (0.40) RXRARXRGRXRBRARGRARB
SCHEMBL6879674 0.92 RXRA (0.47) RXRARXRGRXRBRARGRARB
SCHEMBL6927632 0.90 RXRA (0.44) RXRARXRGRXRBRARGRARB
SCHEMBL6927451 0.89 RXRA (0.42) RXRARXRGRXRBRARGRARB
SCHEMBL6870763 0.85 RXRA (0.43) RXRARXRGRXRBRARGRARB
SCHEMBL6870970 0.80 RXRA (0.48) RXRARXRGRXRBRARGRARB
SCHEMBL6876540 0.80 RXRA (0.47) RXRARXRGRXRBRARGRARB
SCHEMBL6876425 0.79 RXRA (0.53) RXRARXRGRXRBRARGRARB
SCHEMBL6874284 0.79 RXRA (0.50) RXRARXRGRXRBRARGRARB
SCHEMBL6926719 0.78 RXRA (0.48) RXRARXRGRXRBRARGRARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6515021-B1 Bicyclic aromatic compounds CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2003-02-04 US disclosed