SCHEMBL1704262

SCHEMBL1704262

CC(C)(C)OC(=O)N1CCN(c2cc(-c3cc(CO)cc(Nc4cnccn4)n3)ccn2)CC1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 13/20 0.51
TBK1 Q9UHD2 2/20 0.47
SYK P43405 2/20 0.45
GPR119 Q8TDV5 1/20 0.45
WNT3A P56704 1/20 0.43
ACHE P22303 1/20 0.43

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
SCHEMBL1704675 0.93 KARS1 (0.51) KARS1TBK1SYKGPR119WNT3A
SCHEMBL901333 0.89 KARS1 (0.65) KARS1TBK1SYKGPR119
SCHEMBL1704732 0.88 KARS1 (0.52) KARS1TBK1SYKGPR119
SCHEMBL1704453 0.88 KARS1 (0.52) KARS1TBK1SYKGPR119
SCHEMBL902995 0.88 KARS1 (0.67) KARS1TBK1SYKGPR119WNT3A
SCHEMBL1704341 0.88 KARS1 (0.55) KARS1SYKGPR119ACHE
SCHEMBL901508 0.88 KARS1 (0.56) KARS1TBK1SYKGPR119
SCHEMBL901988 0.87 KARS1 (0.55) KARS1
SCHEMBL902972 0.87 KARS1 (0.51) KARS1TBK1SYKGPR119
SCHEMBL1704933 0.87 KARS1 (0.53) KARS1TBK1SYKGPR119

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-2441755-A1 Pyridine- and isoquinoline-derivatives as Syk and JAK kinase inhibitors Almirall, S.A. (ES) 2012-04-18 EP disclosed