SCHEMBL7703913

SCHEMBL7703913

CCOC(=O)c1ccc(N(CC2CC2)c2ccc3c(c2)N(C(C)C)CCC3(C)C)cc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARA P10276 6/20 0.57
RARB P10826 6/20 0.57
RARG P13631 3/20 0.46
RXRA P19793 5/20 0.42
RXRB P28702 5/20 0.42
RXRG P48443 5/20 0.42
FDFT1 P37268 1/20 0.37
PTGER4 P35408 1/20 0.34
NPY2R P49146 1/20 0.33
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
HTT P42858 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
RECQL P46063 1/20 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
SCHEMBL7712306 0.90 RARA (0.61) RARARARBRARGRXRARXRB
SCHEMBL7709680 0.88 RARB (0.59) RARARARBRARGRXRARXRB
SCHEMBL8115004 0.82 RARA (0.69) RARARARBRARGRXRARXRB
SCHEMBL8118100 0.80 RARA (0.66) RARARARBRARGRXRARXRB
SCHEMBL7706907 0.79 RARA (0.59) RARARARBRARGRXRARXRB
SCHEMBL7709721 0.78 RARA (0.63) RARARARBRARGHTTHPGD
SCHEMBL8116841 0.78 RXRA (0.65) RARARARBRARGRXRARXRB
SCHEMBL7706886 0.78 RARA (0.71) RARARARBRARGRXRARXRB
SCHEMBL8115665 0.78 RXRA (0.53) RARARARBRARGRXRARXRB
SCHEMBL8115666 0.77 RARB (0.57) RARARARBRARGRXRARXRB

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