SCHEMBL13634276

SCHEMBL13634276

CC[C@H]1C[C@@H](O)CN1C(N)=S

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.35
DPP4 P27487 2/20 0.30
DPP8 Q6V1X1 2/20 0.30
DPP9 Q86TI2 2/20 0.30
PIK3CD O00329 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
SCHEMBL3434914 0.82 ATM (0.32) ATM
SCHEMBL19577902 0.81 ATM (0.39) ATMDPP4DPP8DPP9PIK3CD
SCHEMBL13638963 0.80 PDK1 (0.36) ATM
SCHEMBL2933741 0.74 ATM (0.44) ATMDPP4DPP8DPP9PIK3CD
SCHEMBL16518661 0.74 ATM (0.53) ATMDPP4DPP8DPP9PIK3CD
SCHEMBL22946712 0.73 CHRNB2 (0.40) ATMDPP4DPP8DPP9PIK3CD
SCHEMBL29634487 0.71
SCHEMBL13360296 0.70 DPP4 (0.43) DPP4DPP8DPP9PIK3CD
SCHEMBL13360294 0.70 CHRNB2 (0.43) ATMDPP4DPP8DPP9PIK3CD
SCHEMBL19710591 0.70 PIK3CD (0.59) ATMDPP4DPP8DPP9PIK3CD

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
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed