SCHEMBL8569274

SCHEMBL8569274

C=C(c1ccccc1)c1cc([N+](=O)[O-])c2ccccc2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
RAB9A P51151 3/20 0.43
MAPT P10636 3/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 3/20 0.42
TSHR P16473 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ABCG2 Q9UNQ0 3/20 0.41
ABCB1 P08183 1/20 0.41
POLB P06746 1/20 0.41
HPRT1 P00492 1/20 0.41
CASP6 P55212 1/20 0.41
GUSB P08236 1/20 0.40
F2 P00734 1/20 0.40
C1R P00736 1/20 0.40
PIM1 P11309 2/20 0.40
PIM3 Q86V86 2/20 0.40
NPC1 O15118 1/20 0.40

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
SCHEMBL8568311 0.82 ALOX15 (0.53) MEN1KMT2ARAB9AMAPTMAPK1
SCHEMBL8567699 0.79 ALDH1A1 (0.48) MEN1KMT2ARAB9AMAPTMAPK1
SCHEMBL8559145 0.79 GRM2 (0.52) MEN1KMT2ARAB9AMAPTMAPK1
SCHEMBL8566524 0.75 MEN1 (0.53) MEN1KMT2ARAB9AMAPTMAPK1
SCHEMBL8561159 0.75 SMN1; SMN2 (0.42) MEN1KMT2ARAB9AMAPTMAPK1
SCHEMBL8559983 0.74 MAPT (0.42) MEN1KMT2ARAB9AMAPTMAPK1
SCHEMBL3298254 0.73 KMT2A (0.54) MEN1KMT2ARAB9AMAPTMAPK1
SCHEMBL8562154 0.73 POLB (0.43) MEN1KMT2ARAB9AMAPTMAPK1
SCHEMBL8568794 0.73 HPGD (0.54) MEN1KMT2AMAPK1SMN1; SMN2ALDH1A1
SCHEMBL8597709 0.73 ALDH1A1 (0.44) MEN1KMT2ARAB9AMAPTMAPK1

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