SCHEMBL3403664

SCHEMBL3403664

CC(C)[Si](C(C)C)(C(C)C)n1ccc2cc(C#N)cnc21

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 2/20 0.38
IRAK4 Q9NWZ3 17/20 0.38
PTGER4 P35408 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
SCHEMBL417021 0.78 CCR1 (0.40)
SCHEMBL4478005 0.77 IRAK4 (0.34) IRAK4
SCHEMBL413086 0.77 ENPP3 (0.39)
SCHEMBL5615371 0.77
SCHEMBL855838 0.77 HPGD (0.36) IRAK4
SCHEMBL904725 0.76 HPGDS (0.43) HPGDSIRAK4PTGER4
SCHEMBL29533363 0.75 HTR2C (0.35)
SCHEMBL12147023 0.75 PARP1 (0.34)
SCHEMBL5055520 0.73 PTGER4 (0.38) PTGER4
SCHEMBL30643452 0.73 KCNH2 (0.35)

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-2251341-A1 Heterocyclic Janus kinase 3 inhibitors Astellas Pharma Inc. (JP) 2010-11-17 EP disclosed