SCHEMBL11088352

SCHEMBL11088352

O=C(O)/C(=N/O)c1ccc(O)c([N+](=O)[O-])c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.49
TSHR P16473 2/20 0.49
GPR35 Q9HC97 2/20 0.49
ALDH1A1 P00352 1/20 0.49
TP53 P04637 1/20 0.49
HPGD P15428 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
KDM4E B2RXH2 2/20 0.47
MAPT P10636 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
LMNA P02545 2/20 0.47
USP2 O75604 1/20 0.47
CYP2C19 P33261 1/20 0.47
PHPT1 Q9NRX4 1/20 0.47
CASP6 P55212 1/20 0.47
ALOX15 P16050 1/20 0.47
HSD17B10 Q99714 1/20 0.47
ALDH5A1 P51649 1/20 0.45
ABAT P80404 1/20 0.45
CA12 O43570 1/20 0.45

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
SCHEMBL11088359 1.00 MAPK1 (0.49) MAPK1TSHRGPR35ALDH1A1TP53
SCHEMBL9658211 0.82 TPMT (0.46) MAPK1TSHRGPR35ALDH1A1TP53
SCHEMBL9658209 0.82 TPMT (0.46) MAPK1TSHRGPR35ALDH1A1TP53
SCHEMBL9660912 0.80 GPR35 (0.55) MAPK1TSHRGPR35ALDH1A1TP53
SCHEMBL106249 0.80 CASP6 (0.72) MAPK1TSHRGPR35ALDH1A1TP53
SCHEMBL2636747 0.80 CASP6 (0.72) MAPK1TSHRGPR35ALDH1A1TP53
SCHEMBL9469176 0.78 CASP6 (0.70) MAPK1TSHRGPR35ALDH1A1TP53
SCHEMBL1898142 0.78 CASP6 (0.70) MAPK1TSHRGPR35ALDH1A1TP53
SCHEMBL7103159 0.78 VCAM1 (0.65) MAPK1TSHRGPR35ALDH1A1TP53
SCHEMBL2156599 0.78 MAPK1 (0.60) MAPK1TSHRGPR35ALDH1A1TP53

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
US-4473566-A BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-09-25 US disclosed
US-4254117-A BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-03-03 US disclosed
US-4143166-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1979-03-06 US disclosed