SCHEMBL23601427

SCHEMBL23601427

CN(c1cc(Br)ccc1Cl)c1nc2nncn2c2cc(Cl)ccc12

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 11/20 0.36
HRH4 Q9H3N8 2/20 0.34
PRMT5 O14744 4/20 0.33
CYP1A2 P05177 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HRH3 Q9Y5N1 1/20 0.32
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
PARP15 Q460N3 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31
PARP2 Q9UGN5 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL23576913 0.90 HRH4 (0.36) MAT2AHRH4PRMT5CYP1A2SMN1; SMN2
SCHEMBL29909169 0.90 HRH4 (0.36) MAT2AHRH4PRMT5CYP1A2SMN1; SMN2
SCHEMBL23601425 0.83 MAT2A (0.36) MAT2AHRH4PRMT5CYP1A2SMN1; SMN2
SCHEMBL29909162 0.83 PDGFRB (0.38) MAT2AHRH4PRMT5CYP1A2FNTA
SCHEMBL23577196 0.83 PDGFRB (0.38) MAT2AHRH4PRMT5CYP1A2FNTA
SCHEMBL23601426 0.82 MAT2A (0.36) MAT2AHRH4PRMT5CYP1A2SMN1; SMN2
SCHEMBL23601423 0.80 MAT2A (0.35) MAT2AHRH4HRH3FNTAFNTB
SCHEMBL23577423 0.80 MAT2A (0.36) MAT2AHRH4PRMT5CYP1A2SMN1; SMN2
SCHEMBL29909955 0.80 MAT2A (0.36) MAT2AHRH4PRMT5CYP1A2SMN1; SMN2
SCHEMBL23576693 0.79 MAT2A (0.35) MAT2AHRH4PRMT5CYP1A2SMN1; SMN2

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