SCHEMBL14744496

SCHEMBL14744496

CCCNC(=O)c1cn(COCC[Si](C)(C)C)c2ncc(-c3n[nH]c4cc(Cl)cc(CF)c34)nc12

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.32
CNR1 P21554 2/20 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
SCHEMBL14738846 0.92 DGAT1 (0.32) DGAT1CNR1
SCHEMBL14743870 0.90 DGAT1 (0.32) DGAT1
SCHEMBL14738845 0.83 SYK (0.35) DGAT1
SCHEMBL14738054 0.82 DGAT1 (0.33) DGAT1
SCHEMBL14744385 0.81 MAPT (0.33) DGAT1
SCHEMBL14746970 0.80 HCAR2 (0.33) DGAT1
SCHEMBL14737449 0.79 JAK2 (0.41) DGAT1CNR1
SCHEMBL14744226 0.79 SYK (0.34) DGAT1
SCHEMBL14738342 0.77 SYK (0.43) DGAT1
SCHEMBL14737439 0.77 MAPK1 (0.32) DGAT1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2763990-A1 PYRROLOPYRAZINE KINASE INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2014-08-13 EP disclosed
WO-2013030138-A1 PYRROLOPYRAZINE KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2013-03-07 WO disclosed