SCHEMBL9874699

SCHEMBL9874699

CCN(CC)c1ccccc1/N=N/c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.48
MEN1 O00255 7/20 0.48
KMT2A Q03164 7/20 0.48
RAB9A P51151 6/20 0.48
MAPK1 P28482 5/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
NPC1 O15118 4/20 0.48
TNNI3 P19429 1/20 0.48
TNNT2 P45379 1/20 0.48
TNNC1 P63316 1/20 0.48
KEAP1 Q14145 1/20 0.48
NFE2L2 Q16236 1/20 0.48
NQO2 P16083 1/20 0.46
ALDH1A1 P00352 6/20 0.45
LMNA P02545 3/20 0.45
HTT P42858 2/20 0.45
POLB P06746 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
TP53 P04637 1/20 0.44
CASP3 P42574 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
SCHEMBL8763712 1.00 MAPT (0.48) MAPTMEN1KMT2ARAB9AMAPK1
SCHEMBL8763718 0.84 HTT (0.51) MAPTMEN1KMT2ARAB9AMAPK1
SCHEMBL8858287 0.80 ALDH1A1 (0.44) MAPTMEN1KMT2ARAB9AMAPK1
SCHEMBL5496325 0.80 ALDH1A1 (0.44) MAPTMEN1KMT2ARAB9AMAPK1
SCHEMBL14582128 0.80 NQO2 (0.48) MAPTMEN1KMT2ARAB9AMAPK1
SCHEMBL28323160 0.80 NQO2 (0.49) MAPTMEN1KMT2ARAB9AMAPK1
SCHEMBL9718487 0.79 NPC1 (0.43) MAPTMEN1KMT2ARAB9AMAPK1
SCHEMBL9718484 0.79 NPC1 (0.43) MAPTMEN1KMT2ARAB9AMAPK1
SCHEMBL1309519 0.79 MAPT (0.56) MAPTMEN1KMT2ARAB9AMAPK1
SCHEMBL1309521 0.79 MAPT (0.56) MAPTMEN1KMT2ARAB9AMAPK1

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
WO-1991009842-A1 ELECTRO-OPTICAL MATERIALS AND LIGHT MODULATOR DEVICES CONTAINING SAME ALLIED-SIGNAL INC. (US) 1991-07-11 WO claimed