SCHEMBL11721840

SCHEMBL11721840

Cc1ccc(C(=O)NC(=O)c2cncc([N+](=O)[O-])c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ MEN1 O00255 5/20 0.53
▸ KMT2A Q03164 5/20 0.53
▸ POLB P06746 3/20 0.53
▸ CRHBP P24387 2/20 0.53
▸ CRHR2 Q13324 2/20 0.53
▸ GAA P10253 4/20 0.50
▸ PTGS2 P35354 1/20 0.48
▸ MAPT P10636 4/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ HPGD P15428 1/20 0.47
▸ LMNA P02545 1/20 0.46
▸ XBP1 P17861 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46

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
SCHEMBL11719928 0.88 KMT2A (0.51) SMN1; SMN2MEN1KMT2APOLBGAA
SCHEMBL11724335 0.86 FLT1 (0.49) SMN1; SMN2MEN1KMT2APOLBGAA
SCHEMBL11725373 0.86 MEN1 (0.53) SMN1; SMN2MEN1KMT2APOLBGAA
SCHEMBL11723169 0.85 ALOX5 (0.54) SMN1; SMN2MEN1KMT2AGAAMAPT
SCHEMBL11718597 0.82 GAA (0.48) HTTSMN1; SMN2MEN1KMT2APOLB
SCHEMBL11718691 0.82 GAA (0.50) SMN1; SMN2MEN1KMT2APOLBGAA
SCHEMBL11060783 0.82 MEN1 (0.73) HTTSMN1; SMN2MEN1KMT2APOLB
SCHEMBL11721984 0.80 SMN1; SMN2 (0.51) HTTSMN1; SMN2MEN1KMT2APOLB
SCHEMBL11726559 0.79 GAA (0.45) SMN1; SMN2MEN1KMT2APOLBGAA
SCHEMBL11725136 0.77 MAPT (0.54) SMN1; SMN2MEN1KMT2APOLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4053608-A 3-NITROPYRIDINE CARBOXAMIDES, POULTRY FEED SANKYO COMPANY LIMITED (JA) 1977-10-11 — — US disclosed
Send feedback