SCHEMBL7709681

SCHEMBL7709681

Cc1cc2c(cc1N)C(C)(C)CC(=O)N2C(C)C

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RARA P10276 2/20 0.46
RARB P10826 2/20 0.46
RARG P13631 2/20 0.46
RXRA P19793 9/20 0.44
HSD17B10 Q99714 1/20 0.42
ATAD2 Q6PL18 1/20 0.32
MAP3K5 Q99683 1/20 0.30

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
SCHEMBL7703951 0.86 RARA (0.46) RARARARBRARGRXRA
SCHEMBL3496914 0.83 RXRA (0.47) RARARARBRARGRXRA
SCHEMBL7709931 0.78 RARA (0.56) RARARARBRARGRXRAATAD2
SCHEMBL7703988 0.77 RARA (0.57) RARARARBRARGRXRAHSD17B10
SCHEMBL7710016 0.77 RARA (0.57) RARARARBRARGRXRAHSD17B10
SCHEMBL7703905 0.75 RARA (0.56) RARARARBRARGRXRA
SCHEMBL6221699 0.75 RARA (0.56) RARARARBRARGRXRA
SCHEMBL17675353 0.72 RARA (0.56) RARARARBRARGRXRA
SCHEMBL9091776 0.71 RARA (0.51) RARARARBRARGRXRA
SCHEMBL7709737 0.71 RARA (0.43) RARARARBRARGHSD17B10

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-1228042-A2 TETRAHYDROQUINOLINE DERIVATIVES HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY Allergan Sales, Inc. (US) 2002-08-07 EP disclosed
WO-2001012606-A2 TETRAHYDROQUINOLINE DERIVATIVES HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY ALLERGAN SALES, INC. (US) 2001-02-22 WO disclosed
US-6127382-A AN ANTIPROLIFERATIVE AGENT FOR TREATING SKIN-RELATED DISEASES, AN ANTITUMOR AGENT TREATING CANCER, AN ANTIINFLAMMATORY AGENT TREATING PULMONARY FIBROSIS, ILEITIS, COLITIS AND KROHN'S DISEASE ALLERGAN SALES, INC. (US) 2000-10-03 US disclosed
US-6114546-A Aminomethylene derivatives and ultraviolet absorbent comprising thereof CHEMIPRO KASEI KAISHA, LIMITED (JP) 2000-09-05 US disclosed
EP-0950655-A1 AMINOMETHYLENE DERIVATIVES AND ULTRAVIOLET ABSORBER COMPRISING THE SAME CHEMIPRO KASEI KAISHA, LIMITED (JP) 1999-10-20 EP disclosed