SCHEMBL10779335

SCHEMBL10779335

CN(C)c1cccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BAZ1A Q9NRL2 1/20 0.76
▸ MEN1 O00255 7/20 0.62
▸ KMT2A Q03164 7/20 0.62
▸ MAPT P10636 5/20 0.60
▸ POLB P06746 2/20 0.60
▸ DDX3X O00571 1/20 0.60
▸ HTT P42858 1/20 0.60
▸ CTDSP1 Q9GZU7 1/20 0.60
▸ PTGES O14684 1/20 0.59
▸ GAA P10253 2/20 0.56
▸ KDR P35968 1/20 0.56
▸ NPC1 O15118 4/20 0.56
▸ LMNA P02545 2/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ MAPK1 P28482 2/20 0.56
▸ RAB9A P51151 3/20 0.56
▸ TP53 P04637 2/20 0.56
▸ TSHR P16473 1/20 0.56
▸ NFKB1 P19838 1/20 0.56
▸ NFKB2 Q00653 1/20 0.56

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
SCHEMBL6296057 0.86 BAZ1A (0.74) BAZ1AMEN1KMT2AMAPTPOLB
SCHEMBL11427771 0.85 MEN1 (0.62) BAZ1AMEN1KMT2AMAPTPOLB
SCHEMBL18311495 0.81 MAPT (0.62) BAZ1AMEN1KMT2AMAPTGAA
SCHEMBL30469233 0.80 MAPT (0.75) MEN1KMT2AMAPTNPC1LMNA
SCHEMBL4921262 0.80 MAPT (0.75) MEN1KMT2AMAPTNPC1LMNA
SCHEMBL709156 0.80 MEN1 (0.70) BAZ1AMEN1KMT2AMAPTPOLB
SCHEMBL11055960 0.79 MEN1 (0.85) MEN1KMT2AMAPTPOLBDDX3X
SCHEMBL11433748 0.79 MEN1 (0.71) BAZ1AMEN1KMT2AMAPTPOLB
SCHEMBL27880343 0.79 MEN1 (0.70) BAZ1AMEN1KMT2AMAPTPOLB
SCHEMBL6302157 0.79 MEN1 (1.00) MEN1KMT2AMAPTPOLBPTGES

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
US-4695633-A Chromogenic 4,4-diaryl-dihydroquinazolones, their preparation and their use BAYER AKTIENGESELLSCHAFT (DE) 1987-09-22 — — US disclosed
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