SCHEMBL493737

SCHEMBL493737

COc1ccc(-c2noc(C(=O)NCC(=O)NC3CCC(C(c4ccccc4)N(C)C)CC3)n2)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 1/20 0.49
MAPT P10636 1/20 0.49
HPGD P15428 1/20 0.48
POLB P06746 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
SCHEMBL493429 0.92 HPGD (0.51) KMT2AKDM4EMAPTHPGD
SCHEMBL494415 0.89 TSHR (0.42) KMT2AHPGDPOLB
SCHEMBL492913 0.87 RAB9A (0.39) KMT2AKDM4EMAPTHPGD
SCHEMBL493647 0.87 KDM4E (0.48) KMT2AKDM4EMAPTHPGD
SCHEMBL493677 0.86 KMT2A (0.49) KMT2AKDM4EMAPTHPGD
SCHEMBL493863 0.86 LMNA (0.48) KMT2AMAPT
SCHEMBL493820 0.85 RAB9A (0.40) HPGD
SCHEMBL493600 0.84 GHSR (0.40) KMT2AKDM4EMAPTPOLB
SCHEMBL493779 0.83 SMN1; SMN2 (0.52) KMT2AKDM4EMAPTHPGDPOLB
SCHEMBL493223 0.82 RAB9A (0.38) KMT2AKDM4EMAPT

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-8106055-B2 Substituted amide compounds GRUENENTHAL GMBH (DE) 2012-01-31 US claimed