SCHEMBL286986

SCHEMBL286986

CCOC(=O)c1ccccc1NC(=O)C1=CN(CC(=O)c2ccc(Cl)cc2Cl)C=CC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
LMNA P02545 3/20 0.46
THRB P10828 1/20 0.46
TSHR P16473 5/20 0.44
NPSR1 Q6W5P4 4/20 0.44
HSD17B10 Q99714 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAPK1 P28482 1/20 0.44
CREBBP Q92793 1/20 0.44
RAB9A P51151 1/20 0.44
TP53 P04637 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
HTT P42858 1/20 0.44
KDM4E B2RXH2 4/20 0.43
POLB P06746 4/20 0.43
ALDH1A1 P00352 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43

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
SCHEMBL287235 0.81 TSHR (0.63) MAPTLMNATSHRNPSR1HSD17B10
SCHEMBL287729 0.81 NPSR1 (0.47) MAPTLMNATSHRNPSR1HSD17B10
SCHEMBL287385 0.80 ALDH1A1 (0.46) MAPTTHRBSMN1; SMN2MAPK1RAB9A
SCHEMBL7808649 0.79 ALDH1A1 (0.42) MAPTLMNATHRBMAPK1RAB9A
SCHEMBL660547 0.76 ALDH1A1 (0.39) TSHRMAPK1HTTPOLBALDH1A1
SCHEMBL286985 0.76 SMN1; SMN2 (0.41) MAPTLMNATHRBNPSR1SMN1; SMN2
SCHEMBL662087 0.75 KMT2A (0.47) MAPTLMNATHRBTSHRMAPK1
SCHEMBL661083 0.75 ALDH1A1 (0.39) MAPTLMNATHRBMAPK1TDP1
SCHEMBL661570 0.75 ALDH1A1 (0.51) LMNATHRBMAPK1TDP1POLB
SCHEMBL27871714 0.74 ALDH1A1 (0.45) MAPTLMNATHRBTSHRNPSR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2427432-A2 NOVEL HETEROCYCLIC COMPOUNDS Torrent Pharmaceuticals Limited (IN) 2012-03-14 EP claimed
WO-2010128528-A2 NOVEL HETEROCYCLIC COMPOUNDS TORRENT PHARMACEUTICALS LIMITED (IN) 2010-11-11 WO claimed