SCHEMBL7703916

SCHEMBL7703916

Cc1cc2c(cc1N(CC1CC1)c1ccccc1C(=O)O)C(C)(C)CCN2C(C)C

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RARA P10276 4/20 0.41
RARB P10826 4/20 0.41
RARG P13631 2/20 0.41
RXRA P19793 9/20 0.38
RXRB P28702 8/20 0.38
RXRG P48443 8/20 0.38
PTPN1 P18031 3/20 0.36
LTC4S Q16873 4/20 0.33

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
SCHEMBL8123213 0.89 RXRA (0.47) RARARARBRARGRXRARXRB
SCHEMBL7712287 0.88 RARA (0.43) RARARARBRARGRXRARXRB
SCHEMBL8115665 0.85 RXRA (0.53) RARARARBRARGRXRARXRB
SCHEMBL8116214 0.75 RXRA (0.69) RARARARBRARGRXRARXRB
SCHEMBL8113512 0.74 RXRA (0.56) RARARARBRARGRXRARXRB
SCHEMBL7709680 0.73 RARB (0.59) RARARARBRARGRXRARXRB
SCHEMBL8114654 0.71 RXRA (0.67) RARARARBRARGRXRARXRB
SCHEMBL8123216 0.71 AKT1 (0.45) RARARARBRARG
SCHEMBL7710046 0.71 RXRA (0.69) RARARARBRARGRXRARXRB
SCHEMBL7706903 0.71 RARA (0.43) RARARARBRARGRXRA

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 3 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