SCHEMBL7706883

SCHEMBL7706883

CCOC(=O)c1ccc(NCc2ccc3c(c2)C(C)(C)CCN3C(C)C)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARA P10276 6/20 0.67
RARB P10826 6/20 0.67
MAPT P10636 4/20 0.51
ALDH1A1 P00352 3/20 0.51
LMNA P02545 3/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
USP2 O75604 1/20 0.51
ALOX15 P16050 1/20 0.51
HSD17B10 Q99714 1/20 0.51
RARG P13631 3/20 0.48
RAB9A P51151 6/20 0.47
NPC1 O15118 4/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
HPGD P15428 1/20 0.41
RECQL P46063 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.39
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL8115008 0.91 RARA (0.65) RARARARBMAPTALDH1A1LMNA
SCHEMBL8116895 0.87 RARB (0.62) RARARARBMAPTALDH1A1MEN1
SCHEMBL8115557 0.87 RARA (0.62) RARARARBMAPTALDH1A1LMNA
SCHEMBL7703933 0.86 RARA (0.72) RARARARBMAPTALDH1A1LMNA
SCHEMBL7710034 0.86 RARA (0.61) RARARARBMAPTALDH1A1LMNA
SCHEMBL7712308 0.83 RARA (0.58) RARARARBMAPTALDH1A1LMNA
SCHEMBL8115010 0.83 RARA (0.67) RARARARBALDH1A1LMNAMEN1
SCHEMBL7703980 0.82 MEN1 (0.50) RARARARBMAPTALDH1A1LMNA
SCHEMBL7709721 0.81 RARA (0.63) RARARARBMAPTALDH1A1LMNA
SCHEMBL26471795 0.81 RARA (1.00) RARARARBMAPTALDH1A1RARG

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