SCHEMBL2043679

SCHEMBL2043679

OC1CCOCC1c1nccs1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 1/20 0.33
KIF11 P52732 1/20 0.31
GRM4 Q14833 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
SCHEMBL7165129 0.76 ALDH1A1 (0.38)
SCHEMBL31610616 0.76 PIK3C3 (0.35) PIK3C3KIF11GRM4
SCHEMBL2053635 0.73 NOS3 (0.35) KIF11
SCHEMBL2039390 0.72 PARP1 (0.30)
SCHEMBL2036928 0.72 CHRM2 (0.43)
SCHEMBL12482758 0.72 MAPK1 (0.36) PIK3C3KIF11
SCHEMBL2037374 0.69 CHRM2 (0.40)
SCHEMBL27858991 0.68 PIK3C3 (0.32) PIK3C3KIF11
SCHEMBL2035875 0.68 KDM4E (0.40)
SCHEMBL29539147 0.68 KIF11 (0.42) PIK3C3KIF11

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-2513098-A1 AMINOPYRIMIDINES AS SYK INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-10-24 EP disclosed
WO-2011075515-A1 AMINOPYRIMIDINES AS SYK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-06-23 WO disclosed