SCHEMBL8561264

SCHEMBL8561264

COCCOc1cc(N)cnc1[N+](=O)[O-]

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 14/20 0.39
NPC1 O15118 4/20 0.39
RAB9A P51151 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
MAPT P10636 4/20 0.38
LMNA P02545 3/20 0.38
HPGD P15428 3/20 0.38
ALDH1A1 P00352 3/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
PLAU P00749 1/20 0.35

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
SCHEMBL8596671 0.84 SMN1; SMN2 (0.41) NPC1RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL2656846 0.82 S1PR4 (0.50) S1PR4NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL8564259 0.82 ALDH1A1 (0.37) S1PR4NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL2657236 0.76 MAPT (0.46) S1PR4NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL8563266 0.75 ALDH1A1 (0.36) S1PR4NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL5512119 0.75 RECQL (0.50) NPC1RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL25873581 0.74 PLAU (0.40) PLAU
SCHEMBL4619552 0.74 KMT2A (0.53) NPC1RAB9AMAPTMEN1KMT2A
SCHEMBL8560385 0.73 ALDH1A1 (0.43) NPC1RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL8563136 0.73 IKBKB (0.45) S1PR4NPC1RAB9ASMN1; SMN2MAPT

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-0735025-B1 Process for producing aminonitropyridines SUMITOMO CHEMICAL CO (JP) 1998-07-01 EP disclosed
US-5648496-A AMINATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-15 US disclosed
EP-0735025-A1 Process for producing aminonitropyridines SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-10-02 EP disclosed