SCHEMBL23601460

SCHEMBL23601460

Cc1cccc(N(CC(F)F)c2nc3nncn3c3cccc(F)c23)c1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
MAPT P10636 3/20 0.35
CRY1 Q16526 3/20 0.34
CRY2 Q49AN0 3/20 0.34
PER2 O15055 1/20 0.34
TSHR P16473 2/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34
RECQL P46063 1/20 0.32
MEN1 O00255 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL23601010 0.90 CRY1 (0.33) TP53SMN1; SMN2MAPTCRY1CRY2
SCHEMBL23601248 0.90 TP53 (0.34) TP53SMN1; SMN2MAPTCRY1CRY2
SCHEMBL23601237 0.88 MAPT (0.34) SMN1; SMN2MAPTCRY1CRY2
SCHEMBL29909319 0.85
SCHEMBL23577507 0.85
SCHEMBL23601056 0.83 MAPT (0.34) MAPTRECQL
SCHEMBL23601852 0.83 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL23601732 0.82
SCHEMBL23577797 0.82
SCHEMBL23577263 0.82

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