SCHEMBL9433467

SCHEMBL9433467

CC(=O)/C(=C\c1cccc([N+](=O)[O-])c1)c1cc2ccccc2[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 2/20 0.56
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
NPC1 O15118 1/20 0.51
POLB P06746 1/20 0.51
GUSB P08236 1/20 0.47
FBP1 P09467 1/20 0.45
MAPT P10636 4/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA7 P43166 1/20 0.44
MAOB P27338 1/20 0.44
LMNA P02545 3/20 0.44
PDGFRB P09619 1/20 0.43
PDGFRA P16234 1/20 0.43
NFE2L2 Q16236 1/20 0.43
HSP90AA1 P07900 1/20 0.43
CCR6 P51684 1/20 0.43
FLT3 P36888 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
SCHEMBL9433473 1.00 GLO1 (0.56) GLO1KMT2AMEN1NPC1POLB
SCHEMBL9433899 0.76 MAPT (0.61) GLO1KMT2AMEN1NPC1POLB
SCHEMBL9433902 0.76 MAPT (0.61) GLO1KMT2AMEN1NPC1POLB
SCHEMBL9434394 0.76 GLO1 (0.54) GLO1KMT2AMEN1NPC1FBP1
SCHEMBL9434400 0.76 GLO1 (0.54) GLO1KMT2AMEN1NPC1FBP1
SCHEMBL9434470 0.75 ALDH1A1 (0.59) GLO1KMT2AMEN1NPC1FBP1
SCHEMBL9433464 0.74 GLO1 (0.61) GLO1KMT2AMEN1NPC1POLB
SCHEMBL9433460 0.74 GLO1 (0.61) GLO1KMT2AMEN1NPC1POLB
SCHEMBL9433701 0.73 GLO1 (0.64) GLO1KMT2ANPC1POLBFBP1
SCHEMBL9433707 0.73 GLO1 (0.64) GLO1KMT2ANPC1POLBFBP1

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
US-5276150-A Vasodilators, anticoagulants, calcium channel blockers FUJIREBIO INC. (JP) 1994-01-04 US disclosed
EP-0400660-A1 1,4-dihydropyridine derivatives FUJIREBIO INC. (JP) 1990-12-05 EP disclosed