SCHEMBL2185089

SCHEMBL2185089

C[Si](C)(C)CCOCn1cnc(-c2cnn(C(CC#N)c3cccc(C(=O)O)c3)c2)c2ccnc1-2

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 4/20 0.33
KDM4C Q9H3R0 4/20 0.32
EIF4EBP1 Q13541 2/20 0.31
BRD4 O60885 1/20 0.31
CREBBP Q92793 1/20 0.31
IDO1 P14902 1/20 0.30

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
SCHEMBL99220 0.81 TPH1 (0.34) DGAT1
SCHEMBL2144873 0.77 CTSL (0.31)
SCHEMBL2144864 0.75 JAK2 (0.39)
SCHEMBL2144867 0.75
SCHEMBL101697 0.75 DGAT1 (0.34) DGAT1
SCHEMBL101565 0.73
SCHEMBL4086968 0.72 JAK2 (0.36)
SCHEMBL2185614 0.70 TPH1 (0.35) DGAT1
SCHEMBL2145094 0.70 CYP3A4 (0.35)
SCHEMBL101261 0.69 JAK2 (0.36)

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-2474545-A1 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors Incyte Corporation (US) 2012-07-11 EP disclosed
EP-2343298-A1 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors Incyte Corporation (US) 2011-07-13 EP disclosed