SCHEMBL19508993

SCHEMBL19508993

CCCN(C)C(=O)c1cc(-c2ccc(NC(C)=O)cc2)nc2ccccc12

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MOK Q9UQ07 11/20 0.70
KMT2A Q03164 3/20 0.69
KDM4E B2RXH2 2/20 0.69
PDE10A Q9Y233 1/20 0.69
MEN1 O00255 2/20 0.65
ALDH1A1 P00352 2/20 0.65
TP53 P04637 1/20 0.56
CYP1A2 P05177 1/20 0.56
HSD17B10 Q99714 1/20 0.56
POLB P06746 1/20 0.56
CYP3A4 P08684 1/20 0.55

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
SCHEMBL19475320 0.83 KMT2A (0.74) MOKKMT2AKDM4EPDE10AMEN1
SCHEMBL19475347 0.82 MOK (1.00) MOKKMT2AKDM4EPDE10AMEN1
SCHEMBL19475498 0.82 KMT2A (0.85) MOKKMT2AKDM4EPDE10AMEN1
SCHEMBL5154506 0.82 KDM4E (1.00) MOKKMT2AKDM4EPDE10AMEN1
SCHEMBL19475306 0.80 MOK (1.00) MOKKMT2AKDM4EPDE10AMEN1
SCHEMBL17308322 0.80 KMT2A (0.81) MOKKMT2AKDM4EPDE10AMEN1
SCHEMBL16603957 0.79 KMT2A (1.00) MOKKMT2AKDM4EPDE10AMEN1
SCHEMBL19475480 0.78 MOK (1.00) MOKKMT2AKDM4EPDE10AMEN1
SCHEMBL19475453 0.77 MOK (0.77) MOKKMT2AKDM4EPDE10AMEN1
SCHEMBL19475332 0.76 MOK (0.84) MOKKMT2AKDM4EPDE10AMEN1

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
WO-2017184547-A1 QUINOLINE COMPOUNDS AS MODULATORS OF RAGE ACTIVITY AND USES THEREOF NEW YORK UNIVERSITY (US) 2017-10-26 WO disclosed