SCHEMBL8600372

SCHEMBL8600372

CCCCCc1nc2ccccc2c([N+](=O)[O-])c1N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
ALOX12 P18054 1/20 0.48
ALDH1A1 P00352 2/20 0.47
GAA P10253 2/20 0.47
MAPT P10636 2/20 0.47
TLR8 Q9NR97 8/20 0.45
ATM Q13315 1/20 0.45
TSHR P16473 1/20 0.44
CYP3A4 P08684 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
KDM4E B2RXH2 1/20 0.43
USP2 O75604 1/20 0.43
GLA P06280 1/20 0.43
HPGD P15428 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
HSD17B10 Q99714 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
SCHEMBL7254199 0.86 LMNA (0.54) LMNASMN1; SMN2ALOX12ALDH1A1GAA
SCHEMBL8566973 0.82 POLB (0.43) LMNASMN1; SMN2ALOX12ALDH1A1MAPT
SCHEMBL28205894 0.82 ALDH1A1 (0.47) LMNASMN1; SMN2ALOX12ALDH1A1GAA
SCHEMBL17145136 0.81 LMNA (0.49) LMNASMN1; SMN2ALOX12ALDH1A1GAA
SCHEMBL27443458 0.81 LMNA (0.44) LMNASMN1; SMN2ALOX12ALDH1A1GAA
SCHEMBL8600045 0.80 TLR8 (0.42) LMNASMN1; SMN2ALOX12ALDH1A1GAA
SCHEMBL8567677 0.80 KMT2A (0.50) LMNASMN1; SMN2ALOX12ALDH1A1GAA
SCHEMBL8596689 0.80 TLR8 (0.61) LMNASMN1; SMN2ALDH1A1GAAMAPT
SCHEMBL15923395 0.79 KDM4E (0.55) LMNASMN1; SMN2ALDH1A1GAAMAPT
SCHEMBL1834273 0.79 TLR8 (0.63) LMNASMN1; SMN2ALDH1A1GAAMAPT

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