SCHEMBL9308263

SCHEMBL9308263

O=[N+]([O-])Nc1cccc2cc(O)ccc12

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 5/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
GAA P10253 1/20 0.42
HNF4A P41235 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
ALOX5 P09917 1/20 0.40
ALDH1A1 P00352 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
POLB P06746 1/20 0.39
CDC25B P30305 1/20 0.39
CASP6 P55212 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
CYP1A2 P05177 1/20 0.37

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
SCHEMBL1135592 0.79 ALDH1A1 (0.52) MEN1KMT2AGAAALOX5ALDH1A1
Nitrous Acid SCHEMBL19282181 0.75 ALOX5 (0.47) MEN1KMT2AGAAALOX5ALDH1A1
Nitrous Acid SCHEMBL6927479 0.75 ALOX5 (0.47) MEN1KMT2AGAAALOX5ALDH1A1
SCHEMBL2934866 0.75 ALDH1A1 (0.61) MEN1KMT2AGAAHNF4AALDH1A1
SCHEMBL27937958 0.74 TLR8 (0.45) TRPV1MEN1KMT2AGAARXFP1
SCHEMBL176305 0.73 RXFP1 (0.54) TRPV1MEN1KMT2AGAARXFP1
SCHEMBL9156203 0.72 CASP6 (0.64) TRPV1MEN1KMT2AGAARXFP1
SCHEMBL23868952 0.71 ESR1 (0.43) TRPV1MEN1KMT2AGAARXFP1
SCHEMBL11147478 0.70 CDC25B (0.65) TRPV1MEN1KMT2AGAARXFP1
SCHEMBL9818523 0.69 HSD17B10 (0.43) TRPV1MEN1KMT2AGAARXFP1

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-5342901-A Film-formable, chelate-forming resin, process for preparation thereof, use thereof and method for forming electrophoretic coating KANSAI PAINT COMPANY, LIMITED (JP) 1994-08-30 US disclosed