SCHEMBL8049916

SCHEMBL8049916

[O-][S+]1CCc2ncnc(NC3(CO)CC3)c21

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 1/20 0.37
▸ JAK1 P23458 1/20 0.37
▸ BTK Q06187 1/20 0.32

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
SCHEMBL30686997 0.87 JAK2 (0.30) JAK2JAK1
SCHEMBL19560011 0.77 — —
SCHEMBL30639341 0.73 LATS1 (0.32) —
SCHEMBL30639342 0.73 LATS1 (0.32) —
SCHEMBL29576569 0.73 LATS1 (0.32) JAK2JAK1
SCHEMBL14734142 0.73 LATS1 (0.32) —
SCHEMBL30758491 0.72 LATS1 (0.30) —
SCHEMBL15088381 0.71 — —
SCHEMBL14754619 0.71 LATS1 (0.31) —
SCHEMBL8063975 0.70 MAPT (0.38) —

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-2215093-B1 NOVEL PIPERAZINO-DIHYDROTHIENOPYRIMIDINE DERIVATIVES BOEHRINGER INGELHEIM INT (DE) 2011-12-14 — — EP disclosed
WO-2009050236-A1 NOVEL PIPERAZINO-DIHYDROTHIENOPYRIMIDINE DERIVATIVES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-23 — — WO disclosed
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