SCHEMBL27947569

SCHEMBL27947569

O=[N+]([O-])C(=Cc1ccccc1)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.51
▸ FBP1 P09467 3/20 0.49
▸ PRMT1 Q99873 1/20 0.47
▸ KMT2A Q03164 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ AKR1B10 O60218 2/20 0.44
▸ AKR1B1 P15121 2/20 0.44
▸ CA12 O43570 1/20 0.44
▸ CA4 P22748 1/20 0.44
▸ CA6 P23280 1/20 0.44
▸ CA5A P35218 1/20 0.44
▸ CA7 P43166 1/20 0.44
▸ CA9 Q16790 1/20 0.44
▸ CA14 Q9ULX7 1/20 0.44
▸ CA5B Q9Y2D0 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ TLR4 O00206 1/20 0.43
▸ TLR2 O60603 1/20 0.43

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
SCHEMBL2343853 0.79 FBP1 (0.58) FBP1PRMT1KMT2AMEN1ALDH1A1
SCHEMBL8507853 0.76 FBP1 (0.59) FBP1PRMT1KMT2AMEN1NPC1
SCHEMBL5955650 0.75 ALDH1A1 (0.52) LMNAKMT2ANPC1RAB9ACA12
SCHEMBL15234446 0.75 FBP1 (0.54) FBP1PRMT1KMT2AMEN1MAOB
SCHEMBL3163836 0.74 ALDH1A1 (0.55) LMNAKMT2ANPC1RAB9ACA12
SCHEMBL29282943 0.74 NR1H4 (0.54) LMNAKMT2AMEN1NPC1RAB9A
SCHEMBL10382637 0.73 HCAR2 (0.57) LMNAKMT2AAKR1B10AKR1B1CA12
SCHEMBL11224683 0.72 FBP1 (0.59) LMNAFBP1PRMT1KMT2AMEN1
SCHEMBL3907983 0.71 LMNA (0.51) LMNAKMT2AMEN1NPC1RAB9A
SCHEMBL10661140 0.71 LMNA (0.56) LMNAKMT2AMEN1AKR1B10AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103497108-B Synthesis method of p-hydroxy-beta-nitrostyrene UNIV NORTH CHINA 2015-06-10 — — CN disclosed
CN-103497108-A Synthesis method of p-hydroxy-beta-nitrostyrene UNIV NORTH CHINA 2014-01-08 — — CN disclosed
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