SCHEMBL18524867

SCHEMBL18524867

Cc1ccc2c(-c3cnc4[nH]cc(OC(=O)NC(C)(C)CO)c4n3)nn(CCCN(C)C)c2c1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SYK P43405 20/20 0.78
KCNH2 Q12809 6/20 0.59
CYP2D6 P10635 4/20 0.59
CYP2C9 P11712 3/20 0.40

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
SCHEMBL18524549 0.96 SYK (0.71) SYKKCNH2CYP2D6CYP2C9
SCHEMBL18524856 0.94 SYK (0.70) SYKKCNH2CYP2D6CYP2C9
SCHEMBL14751472 0.88 SYK (1.00) SYKKCNH2CYP2D6CYP2C9
SCHEMBL18524877 0.87 SYK (0.62) SYKKCNH2CYP2D6CYP2C9
Hydrochloric Acid SCHEMBL14737997 0.87 SYK (0.98) SYKKCNH2CYP2D6CYP2C9
SCHEMBL18524832 0.87 SYK (0.60) SYKKCNH2CYP2D6CYP2C9
SCHEMBL18524779 0.86 SYK (0.58) SYKKCNH2CYP2D6CYP2C9
SCHEMBL18524933 0.86 SYK (0.81) SYKKCNH2CYP2D6CYP2C9
SCHEMBL18524587 0.84 SYK (0.54) SYKKCNH2CYP2D6CYP2C9
SCHEMBL14746310 0.83 SYK (0.91) SYKKCNH2CYP2D6CYP2C9

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 claimed