SCHEMBL9461875

SCHEMBL9461875

C=CCNC(=O)NNc1cccc([N+](=O)[O-])c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.54
▸ MEN1 O00255 4/20 0.54
▸ KMT2A Q03164 4/20 0.54
▸ POLB P06746 3/20 0.54
▸ HTT P42858 2/20 0.54
▸ DDX3X O00571 1/20 0.54
▸ CTDSP1 Q9GZU7 1/20 0.54
▸ SMN1; SMN2 Q16637 4/20 0.51
▸ NPC1 O15118 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ ALDH1A1 P00352 4/20 0.51
▸ LMNA P02545 1/20 0.49
▸ GAA P10253 2/20 0.48
▸ CA12 O43570 1/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA5A P35218 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ CA5B Q9Y2D0 1/20 0.46
▸ BAZ1A Q9NRL2 1/20 0.46

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
SCHEMBL9461541 0.84 MAPT (0.55) MAPTMEN1KMT2APOLBHTT
SCHEMBL31064998 0.80 KMT2A (0.56) MAPTMEN1KMT2APOLBHTT
SCHEMBL9448739 0.79 MAPT (0.54) MAPTMEN1KMT2APOLBHTT
SCHEMBL9462096 0.79 TGM2 (0.50) MEN1KMT2APOLBHTTSMN1; SMN2
SCHEMBL9461426 0.77 POLB (0.49) MAPTKMT2APOLBSMN1; SMN2ALDH1A1
SCHEMBL20984089 0.77 KMT2A (0.65) MAPTMEN1KMT2APOLBHTT
SCHEMBL10433499 0.76 MEN1 (0.63) MAPTMEN1KMT2APOLBHTT
SCHEMBL6570860 0.76 KMT2A (0.62) MAPTMEN1KMT2APOLBHTT
SCHEMBL11764491 0.75 MAPT (0.52) MAPTSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL8599639 0.75 KMT2A (0.61) MAPTMEN1KMT2APOLBHTT

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
EP-0542084-A1 Use of inhibitors of color generation in chromogenic assays Bayer Corporation (US) 1993-05-19 — — EP claimed
US-5212066-A Semicarbazide, thiosemicarbazide and carbazide as inhibiitors of color generation MILES INC. (US) 1993-05-18 — — US claimed
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