SCHEMBL7647178

SCHEMBL7647178

O=C(COCc1ccc([N+](=O)[O-])c(Cl)c1)Nc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.48
MEN1 O00255 5/20 0.48
MAPT P10636 4/20 0.48
HTT P42858 2/20 0.48
LMNA P02545 2/20 0.48
GAA P10253 1/20 0.48
CXCR2 P25025 1/20 0.47
ALDH1A1 P00352 5/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
NPC1 O15118 1/20 0.44
GBA1 P04062 1/20 0.44
MAPK1 P28482 1/20 0.44
RAB9A P51151 1/20 0.44
PTPRC P08575 1/20 0.44
PTPN1 P18031 1/20 0.44
APP P05067 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 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
SCHEMBL7647179 0.88 PTPRC (0.55) KMT2AMEN1MAPTHTTLMNA
SCHEMBL7650195 0.86 ALDH1A1 (0.48) KMT2AMEN1MAPTHTTLMNA
SCHEMBL10599979 0.81 ALDH1A1 (0.52) KMT2AMEN1MAPTHTTALDH1A1
SCHEMBL7647775 0.79 ALDH1A1 (0.50) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL28876320 0.78 TSHR (0.56) MAPTHTTLMNAGAAALDH1A1
SCHEMBL10598307 0.77 KMT2A (0.64) KMT2AMEN1MAPTLMNAALDH1A1
SCHEMBL7146343 0.77 ALDH1A1 (0.46) KMT2AMEN1MAPTHTTLMNA
SCHEMBL7650201 0.77 ALDH1A1 (0.57) KMT2AMEN1MAPTHTTLMNA
SCHEMBL7649330 0.76 CETP (0.55) KMT2AMEN1MAPTHTTLMNA
SCHEMBL839348 0.75 NAMPT (0.66) KMT2AMEN1MAPTHTTALDH1A1

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-6482985-B1 2-benzyloxy-5-halo-acylanilide compounds and method of using them EASTMAN KODAK COMPANY 2002-11-19 US disclosed