SCHEMBL902168

SCHEMBL902168

CC(C)(C)OC(=O)N1CC2CC1CN2c1cc(-c2cc(N)cc(Nc3cc(C(F)(F)F)ccn3)n2)ccn1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SYK P43405 19/20 0.49
HDAC1 Q13547 1/20 0.42

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
SCHEMBL1704543 1.00 SYK (0.49) SYKHDAC1
SCHEMBL1704085 0.89 SYK (0.49) SYK
SCHEMBL1705099 0.86 KARS1 (0.47) SYKHDAC1
SCHEMBL15282758 0.81 CCR2 (0.50) HDAC1
SCHEMBL12969004 0.81 CCR2 (0.50) HDAC1
SCHEMBL901796 0.79 KARS1 (0.45) SYK
SCHEMBL1704569 0.78 SYK (0.46) SYK
SCHEMBL1704571 0.78 SYK (0.46) SYK
SCHEMBL1704545 0.77 SYK (0.48) SYK
SCHEMBL1704871 0.76 KARS1 (0.44) SYK

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-2441755-A1 Pyridine- and isoquinoline-derivatives as Syk and JAK kinase inhibitors Almirall, S.A. (ES) 2012-04-18 EP disclosed
WO-2012041476-A1 PYRIDINE AND ISOQUINOLINE DERIVATIVES AS SYK- AND JAK-KINASE INHIBITORS ALMIRALL, S.A. (ES) 2012-04-05 WO disclosed