SCHEMBL8634653

SCHEMBL8634653

CC(=O)Nc1ccc(/C=C/[N+](=O)[O-])cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 9/20 0.56
EGFR P00533 2/20 0.56
MAPT P10636 6/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 2/20 0.51
LMNA P02545 2/20 0.51
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
MAPK1 P28482 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
HTT P42858 1/20 0.48
ABL1 P00519 1/20 0.47
ABL2 P42684 1/20 0.47

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
SCHEMBL8634657 1.00 FBP1 (0.56) FBP1EGFRMAPTSMN1; SMN2ALDH1A1
SCHEMBL10944710 0.82 SMN1; SMN2 (0.64) MAPTSMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL7941711 0.82 SMN1; SMN2 (0.64) MAPTSMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL7941715 0.82 SMN1; SMN2 (0.64) MAPTSMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL9798856 0.78 MAPT (0.58) MAPTSMN1; SMN2ALDH1A1LMNAKMT2A
SCHEMBL9798850 0.78 MAPT (0.58) MAPTSMN1; SMN2ALDH1A1LMNAKMT2A
SCHEMBL6910818 0.78 FBP1 (0.78) FBP1EGFRMAPTSMN1; SMN2ALDH1A1
SCHEMBL6910815 0.78 FBP1 (0.78) FBP1EGFRMAPTSMN1; SMN2ALDH1A1
SCHEMBL13214359 0.77 FBP1 (0.71) FBP1EGFRMAPTSMN1; SMN2ALDH1A1
SCHEMBL21068154 0.77 HTT (0.46) EGFRMAPTSMN1; SMN2ALDH1A1LMNA

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-5763470-A Benzopyran compounds and methods for their use SUGEN INC. (US) 1998-06-09 US disclosed