SCHEMBL4789344

SCHEMBL4789344

Cc1ccc(N)cc1NC(=O)c1cnc2[nH]ccc2c1Cl

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ AXL P30530 1/20 0.48
▸ PRKCI P41743 1/20 0.48
▸ RXFP1 Q9HBX9 1/20 0.43
▸ BRAF P15056 8/20 0.42
▸ LMNA P02545 1/20 0.40
▸ JAK2 O60674 2/20 0.39
▸ JAK1 P23458 2/20 0.39
▸ TYK2 P29597 2/20 0.39
▸ PIK3CA P42336 3/20 0.38
▸ MTOR P42345 3/20 0.38
▸ RAF1 P04049 1/20 0.38
▸ ARAF P10398 1/20 0.38
▸ MET P08581 1/20 0.37

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
SCHEMBL14027871 0.87 JAK1 (0.42) BRAFJAK2JAK1TYK2PIK3CA
SCHEMBL4863399 0.81 AXL (0.42) AXLPRKCIRXFP1BRAFLMNA
SCHEMBL14026833 0.80 BRAF (0.42) AXLPRKCIRXFP1BRAFJAK2
SCHEMBL4790006 0.77 RAF1 (0.51) RXFP1BRAFRAF1
SCHEMBL14026832 0.76 ABL1 (0.51) BRAFPIK3CAMTOR
SCHEMBL22457384 0.76 MAPK14 (0.61) BRAFRAF1
SCHEMBL4790008 0.76 BRAF (0.62) BRAFRAF1
SCHEMBL12876546 0.75 AXL (0.55) AXLPRKCIJAK2JAK1TYK2
SCHEMBL29378769 0.75 AXL (0.55) AXLPRKCIJAK2JAK1TYK2
SCHEMBL12875920 0.75 AXL (0.51) AXLPRKCIJAK2JAK1TYK2

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-2008144253-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM LLC (BM) 2008-11-27 — — WO disclosed
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