SCHEMBL8566524

SCHEMBL8566524

O=[N+]([O-])c1cc(O)nc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
RAB9A P51151 2/20 0.53
CASP6 P55212 1/20 0.51
MAPT P10636 4/20 0.49
MAPK1 P28482 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ALDH1A1 P00352 3/20 0.49
TSHR P16473 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CTSB P07858 2/20 0.47
KDM4E B2RXH2 1/20 0.47
GAA P10253 1/20 0.47
IDO1 P14902 1/20 0.47
TDO2 P48775 1/20 0.47
POLB P06746 1/20 0.47
HPRT1 P00492 1/20 0.47
ABCB1 P08183 1/20 0.46
ABCG2 Q9UNQ0 1/20 0.46
CRHBP P24387 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
SCHEMBL3298254 0.81 KMT2A (0.54) MEN1KMT2ARAB9ACASP6MAPT
SCHEMBL8568311 0.80 ALOX15 (0.53) MEN1KMT2ARAB9ACASP6MAPT
SCHEMBL483953 0.79 CTSB (0.50) MEN1KMT2ARAB9ACASP6MAPT
SCHEMBL6272457 0.79 ALDH1A1 (0.66) MEN1KMT2ARAB9AMAPTMAPK1
SCHEMBL28232869 0.79 ALDH1A1 (0.66) MEN1KMT2ARAB9AMAPTMAPK1
SCHEMBL8561151 0.79 BACE1 (0.51) MEN1KMT2ARAB9ACASP6MAPT
SCHEMBL8562475 0.79 KMT2A (0.49) MEN1KMT2ARAB9ACASP6MAPT
SCHEMBL2137910 0.79 MAPT (0.52) MEN1KMT2ARAB9ACASP6MAPT
SCHEMBL2136947 0.78 MAPT (0.57) MEN1KMT2ARAB9AMAPTMAPK1
SCHEMBL27795495 0.78 ALDH1A1 (0.64) 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