SCHEMBL7709957

SCHEMBL7709957

CC(C)N1CCC(C)(C)c2cc(N)ccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARA P10276 3/20 0.53
RARB P10826 3/20 0.53
RARG P13631 2/20 0.53
MAPT P10636 5/20 0.35
ALDH1A1 P00352 4/20 0.35
GAA P10253 3/20 0.35
MEN1 O00255 2/20 0.35
THRB P10828 2/20 0.35
KMT2A Q03164 2/20 0.35
NR4A1 P22736 1/20 0.35
PTK2B Q14289 1/20 0.35
RAD52 P43351 2/20 0.33
KDM4E B2RXH2 2/20 0.33
FSHR P23945 1/20 0.33
HTT P42858 1/20 0.33
POLB P06746 1/20 0.33
OPRD1 P41143 5/20 0.32
OPRK1 P41145 3/20 0.32
OPRM1 P35372 2/20 0.32
GFER P55789 1/20 0.31

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
SCHEMBL7709675 0.88 RARA (0.53) RARARARBRARGMAPTALDH1A1
SCHEMBL8293240 0.83 RARA (0.54) RARARARBRARGMAPTALDH1A1
SCHEMBL17675521 0.81 RARA (0.53) RARARARBRARGSIGMAR1
SCHEMBL12715253 0.81 RARA (0.53) RARARARBRARGOPRD1OPRK1
SCHEMBL2061788 0.79 RARA (0.45) RARARARBRARGMAPTALDH1A1
SCHEMBL6290941 0.78 RARA (0.39) RARARARBRARGFSHR
SCHEMBL7706875 0.77 RARA (0.43) RARARARBRARG
SCHEMBL7709737 0.77 RARA (0.43) RARARARBRARGALDH1A1ALOX15
SCHEMBL2625755 0.77 RARA (0.48) RARARARBRARGMAPTALDH1A1
SCHEMBL24202326 0.74 RARA (0.46) RARARARBRARGMAPTALDH1A1

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