SCHEMBL23601025

SCHEMBL23601025

Cc1cccc2c1OCCCN2c1nc2nncn2c2cc(Cl)ccc12

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HTT P42858 1/20 0.44
MAPT P10636 7/20 0.38
POLB P06746 2/20 0.38
HRH4 Q9H3N8 2/20 0.37
TP53 P04637 2/20 0.36
MAP3K5 Q99683 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
ESR1 P03372 1/20 0.33
STAT3 P40763 1/20 0.32
GRM5 P41594 1/20 0.32
PIK3CD O00329 1/20 0.32

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
SCHEMBL23601343 0.89 KMT2A (0.36) HPGDHSD17B10KMT2AKDM4EALDH1A1
SCHEMBL23601479 0.85 KMT2A (0.46) HPGDHSD17B10KMT2AKDM4EALDH1A1
SCHEMBL23601296 0.84 KDM4E (0.34) HPGDHSD17B10KMT2AKDM4EALDH1A1
SCHEMBL31229468 0.84 KDM4E (0.34) HPGDHSD17B10KMT2AKDM4EALDH1A1
SCHEMBL23577430 0.84 KDM4E (0.34) HPGDHSD17B10KMT2AKDM4EALDH1A1
SCHEMBL23601018 0.80 MAPT (0.38) HPGDHSD17B10KMT2AKDM4EALDH1A1
SCHEMBL23576906 0.79 MAPT (0.42) HPGDHSD17B10KMT2AKDM4EALDH1A1
SCHEMBL31229687 0.79 MAPT (0.42) HPGDHSD17B10KMT2AKDM4EALDH1A1
SCHEMBL23601076 0.78 MAPT (0.39) HPGDHSD17B10KMT2AKDM4EALDH1A1
SCHEMBL23601746 0.76 MAPT (0.38) HPGDHSD17B10KMT2AKDM4EALDH1A1

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-2021130638-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS CARNA BIOSCIENCES, INC. (JP) 2021-07-01 WO disclosed