SCHEMBL18534835

SCHEMBL18534835

CC(O)[C@@H](CO)NC(=O)c1cn(COCC[Si](C)(C)C)c2ncc(-c3nn(C)c4cc(F)ccc34)nc12

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SYK P43405 15/20 0.45
CYP2C9 P11712 1/20 0.44
JAK2 O60674 5/20 0.44
JAK1 P23458 5/20 0.44
JAK3 P52333 4/20 0.44
TYK2 P29597 1/20 0.36

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
SCHEMBL14752252 1.00 SYK (0.45) SYKCYP2C9JAK2JAK1JAK3
SCHEMBL14751238 1.00 SYK (0.45) SYKCYP2C9JAK2JAK1JAK3
SCHEMBL14746806 0.94 SYK (0.44) SYKCYP2C9JAK2JAK1JAK3
SCHEMBL14752236 0.94 SYK (0.44) SYKCYP2C9JAK2JAK1JAK3
SCHEMBL14746499 0.92 SYK (0.51) SYKCYP2C9JAK2JAK1JAK3
SCHEMBL14751329 0.90 SYK (0.44) SYKCYP2C9JAK2JAK1JAK3
SCHEMBL14747027 0.90 SYK (0.43) SYKCYP2C9JAK2JAK1JAK3
SCHEMBL14751318 0.90 SYK (0.45) SYKCYP2C9JAK2JAK1JAK3
SCHEMBL14746719 0.89 SYK (0.42) SYKCYP2C9JAK2JAK1JAK3
SCHEMBL14747142 0.89 SYK (0.48) SYKCYP2C9JAK2JAK1JAK3

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-2763990-B1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2017-02-22 EP disclosed