SCHEMBL20008143

SCHEMBL20008143

CCCc1ccc(-c2cc(NC)ccc2C)cn1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BRAF P15056 1/20 0.38
PIK3CD O00329 1/20 0.38
PIK3CB P42338 1/20 0.38
PIK3CG P48736 1/20 0.38
APP P05067 1/20 0.36
ABL1 P00519 8/20 0.36
LRRK2 Q5S007 1/20 0.35
MAPT P10636 1/20 0.35
CTSK P43235 1/20 0.34
MAPK14 Q16539 3/20 0.34
VEGFA P15692 1/20 0.34
FLT1 P17948 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34
LCK P06239 2/20 0.34
KDR P35968 2/20 0.34
JAK3 P52333 2/20 0.34
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33

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
SCHEMBL20009436 0.77 MAPK14 (0.41) ABL1LRRK2MAPK14
SCHEMBL22811167 0.77 RRM2 (0.34) MAPT
SCHEMBL20009415 0.74 RAF1 (0.37) BRAFMAPK14
SCHEMBL20008778 0.73 RAF1 (0.37) BRAFMAPK14
SCHEMBL23654969 0.72 BRAF (0.33) BRAFABL1LRRK2MAPK14LCK
SCHEMBL23654398 0.69 BRAF (0.36) BRAFPIK3CDPIK3CBPIK3CGABL1
SCHEMBL18822208 0.68 PRMT5 (0.41) PIK3CDPIK3CBPIK3CG
SCHEMBL13495562 0.68 GRM5 (0.44) BRAFPIK3CDPIK3CBPIK3CGABL1
SCHEMBL21021589 0.67 APP (0.45) APPABL1LRRK2MAPTMAPK14
SCHEMBL31359595 0.67 SREBF2 (0.47) MAPT

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
EP-3299367-A1 BIARYL AMIDE COMPOUNDS AS KINASE INHIBITORS Novartis AG (CH) 2018-03-28 EP disclosed