SCHEMBL27788942

SCHEMBL27788942

CC(C)(Cc1cnc(Br)s1)OC(N)=O

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ FPR2 P25090 1/20 0.33
▸ RECQL P46063 1/20 0.30
▸ PDK1 Q15118 1/20 0.30
▸ PDK2 Q15119 1/20 0.30
▸ PDK3 Q15120 1/20 0.30
▸ PDK4 Q16654 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
SCHEMBL27810521 0.81 BTK (0.36) SMN1; SMN2RECQL
SCHEMBL27810580 0.81 SMN1; SMN2 (0.31) SMN1; SMN2RECQL
SCHEMBL27779427 0.78 MAPK10 (0.34) SMN1; SMN2FPR2PDK1PDK2PDK3
SCHEMBL27726473 0.77 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL27726471 0.74 ADRB2 (0.31) SMN1; SMN2
SCHEMBL4548405 0.74 SMN1; SMN2 (0.43) SMN1; SMN2RECQL
SCHEMBL28784554 0.73 SMN1; SMN2 (0.38) SMN1; SMN2
SCHEMBL27213267 0.73 — —
SCHEMBL10246306 0.73 LMNA (0.31) —
SCHEMBL28457543 0.72 KDM4E (0.39) SMN1; SMN2FPR2PDK1PDK2PDK3

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
CN-101808666-A Combination of antimitotic and lasokinase inhibitors as anticancer therapy SCHERING CORP 2010-08-18 — — CN disclosed
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