SCHEMBL287981

SCHEMBL287981

CS(=O)(=O)NN(CC(=O)c1cc([N+](=O)[O-])cs1)C(=O)C1=CN=CCC1

nearest known ligand 0.30

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL286788 0.67 MAPT (0.35) MAPTSMN1; SMN2MEN1ALDH1A1RAB9A
SCHEMBL286928 0.64 ALDH1A1 (0.34) SMN1; SMN2MEN1ALDH1A1RAB9AKMT2A
SCHEMBL11213610 0.63 KMT2A (0.49) MAPTSMN1; SMN2MEN1ALDH1A1RAB9A
SCHEMBL287118 0.62 KMT2A (0.33) MAPTSMN1; SMN2MEN1ALDH1A1RAB9A
SCHEMBL27473615 0.59 LMNA (0.31) MAPT
SCHEMBL661855 0.59 LMNA (0.33) MAPT
SCHEMBL2789975 0.59 MAPT (0.48) MAPTSMN1; SMN2MEN1ALDH1A1RAB9A
SCHEMBL6694136 0.58 ALDH1A1 (0.56) MAPTSMN1; SMN2MEN1ALDH1A1RAB9A
SCHEMBL1844829 0.58 MIF (0.43) MAPTSMN1; SMN2MEN1ALDH1A1RAB9A
SCHEMBL1847472 0.57 DAO (0.48) MAPTSMN1; SMN2MEN1ALDH1A1RAB9A

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