SCHEMBL23601713

SCHEMBL23601713

CN(c1ccnc(Br)c1)c1nc(NN)nc2cc(Cl)ccc12

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHKA P35790 1/20 0.39
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
NR4A2 P43354 3/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SOS2 Q07890 1/20 0.35
CSNK2A2 P19784 1/20 0.34
CSNK2B P67870 1/20 0.34
FERMT2 Q96AC1 2/20 0.34
CSF1R P07333 1/20 0.34
KCNH2 Q12809 1/20 0.33
SCN5A Q14524 1/20 0.33
SCN9A Q15858 1/20 0.33
KIT P10721 1/20 0.32
PDGFRA P16234 1/20 0.32
KDR P35968 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP1A2 P05177 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
SCHEMBL29909472 0.83 EGFR (0.41) CHKAGAAMAPTCSNK2A2CSNK2B
SCHEMBL23576849 0.83 EGFR (0.41) CHKAGAAMAPTCSNK2A2CSNK2B
SCHEMBL30961048 0.81 GAA (0.50) CHKAGAAMAPTCSF1R
SCHEMBL23577187 0.81 GAA (0.50) CHKAGAAMAPTCSF1R
SCHEMBL24807698 0.79 GAA (0.36) CHKAGAAMAPTNR4A2CSF1R
SCHEMBL23601276 0.79 GAA (0.40) CHKAGAAMAPTNR4A2LMNA
SCHEMBL29909528 0.77 GAA (0.36) CHKAGAAMAPTNR4A2LMNA
SCHEMBL23577932 0.77 GAA (0.36) CHKAGAAMAPTNR4A2LMNA
SCHEMBL23601802 0.72 CSF1R (0.60) CHKAGAAMAPTCSF1R
SCHEMBL30961034 0.72 CSF1R (0.60) CHKAGAAMAPTCSF1R

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