SCHEMBL7650190

SCHEMBL7650190

CC(=O)Nc1cc(F)c([N+](=O)[O-])cc1OCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.67
BRD4 O60885 11/20 0.62
CTSV O60911 3/20 0.55
CTSL P07711 3/20 0.55
MYC P01106 1/20 0.48
MAX P61244 1/20 0.48
PTGES O14684 1/20 0.47
MEN1 O00255 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
PPIA P62937 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
SCHEMBL7647175 0.86 CYP19A1 (0.67) CYP19A1BRD4CTSVCTSLMYC
SCHEMBL27238124 0.84 CYP19A1 (0.52) CYP19A1BRD4PTGESMEN1MAPT
SCHEMBL7647773 0.81 CYP19A1 (0.60) CYP19A1BRD4CTSVCTSLMEN1
SCHEMBL810439 0.80 PTGES (0.57) CYP19A1CTSVCTSLPTGESMEN1
SCHEMBL30699715 0.80 PTGES (0.57) CYP19A1CTSVCTSLPTGESMEN1
SCHEMBL31235944 0.80 CTSV (0.53) CYP19A1CTSVCTSLPTGESMEN1
SCHEMBL5381129 0.80 CYP19A1 (1.00) CYP19A1BRD4MEN1MAPTKMT2A
SCHEMBL6097716 0.79 PTGES (0.54) CYP19A1CTSVCTSLPTGESMEN1
SCHEMBL7146338 0.79 CYP19A1 (0.57) CYP19A1BRD4CTSVCTSLMYC
SCHEMBL9196201 0.79 ALDH1A1 (0.48) CYP19A1BRD4MEN1MAPTKMT2A

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