SCHEMBL7703980

SCHEMBL7703980

CCOC(=O)c1ccc(NCc2ccc3c(c2)C(C)(C)CC(=O)N3C(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
ALDH1A1 P00352 4/20 0.50
MAPT P10636 3/20 0.50
LMNA P02545 2/20 0.50
USP2 O75604 1/20 0.50
ALOX15 P16050 1/20 0.50
HSD17B10 Q99714 1/20 0.50
RARA P10276 4/20 0.48
RARB P10826 4/20 0.48
RARG P13631 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
RXRA P19793 3/20 0.43
TP53 P04637 1/20 0.40
THRB P10828 1/20 0.40
MAPK1 P28482 1/20 0.40
SENP1 Q9P0U3 1/20 0.39
NPSR1 Q6W5P4 2/20 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
SCHEMBL7710141 0.91 RARA (0.47) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL8119610 0.88 RARA (0.63) MAPTRARARARBRARGRXRA
SCHEMBL7710045 0.87 RARA (0.52) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL7710145 0.83 RARA (0.48) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL7706883 0.82 RARA (0.67) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL8634168 0.81 RARB (0.74) KMT2ARARARARBRARGRXRA
SCHEMBL7703983 0.80 RARA (0.51) ALDH1A1MAPTLMNARARARARB
SCHEMBL7710137 0.79 RARA (0.50) RARARARBRARGRXRAMAPK1
SCHEMBL8122124 0.78 RARA (0.61) MEN1KMT2AALDH1A1RARARARB
SCHEMBL8634937 0.75 RARB (0.74) KMT2ARARARARBRARGRXRA

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