SCHEMBL23601276

SCHEMBL23601276

CN(c1cccc(Br)n1)c1nc(NN)nc2cc(Cl)ccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.40
MAPT P10636 1/20 0.40
ADORA1 P30542 1/20 0.34
KMT2A Q03164 1/20 0.34
NR4A2 P43354 1/20 0.34
POLB P06746 1/20 0.33
PDE10A Q9Y233 2/20 0.32
CHKA P35790 1/20 0.32
ALDH1A1 P00352 1/20 0.32
ADRA2A P08913 1/20 0.32
MCHR1 Q99705 1/20 0.32
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KIT P10721 1/20 0.31
PDGFRA P16234 1/20 0.31
KDR P35968 1/20 0.31
CSNK2A2 P19784 1/20 0.31
CSNK2B P67870 1/20 0.31
IDO1 P14902 1/20 0.31
C1R P00736 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
SCHEMBL30014123 0.84 EGFR (0.39) NR4A2POLBPDE10ACHKALMNA
SCHEMBL23577130 0.84 EGFR (0.39) NR4A2POLBPDE10ACHKALMNA
SCHEMBL23576849 0.82 EGFR (0.41) GAAMAPTKMT2ACHKAKDR
SCHEMBL29909472 0.82 EGFR (0.41) GAAMAPTKMT2ACHKAKDR
SCHEMBL24721493 0.81 MAPT (0.37) GAAMAPTADORA1POLBSMN1; SMN2
SCHEMBL30961048 0.80 GAA (0.50) GAAMAPTADORA1CHKA
SCHEMBL23577187 0.80 GAA (0.50) GAAMAPTADORA1CHKA
SCHEMBL23601713 0.79 CHKA (0.39) GAAMAPTKMT2ANR4A2CHKA
SCHEMBL24807698 0.76 GAA (0.36) GAAMAPTADORA1KMT2ANR4A2
SCHEMBL23577932 0.76 GAA (0.36) GAAMAPTADORA1KMT2ANR4A2

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