SCHEMBL18117397

SCHEMBL18117397

COC(=O)NC(Cc1nccn1C)C(C)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
OPRK1 P41145 1/20 0.34
POLB P06746 1/20 0.34
FNTA P49354 1/20 0.34
FNTB P49356 1/20 0.34
ITGA4 P13612 1/20 0.34
ITGB7 P26010 1/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
NOX1 Q9Y5S8 1/20 0.33
LDHA P00338 1/20 0.33
LDHB P07195 1/20 0.33
CBLB Q13191 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
SCHEMBL14853086 1.00 FDPS (0.38) FDPSSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL690630 0.89 ITGA4 (0.43) FDPSSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL690631 0.89 ITGA4 (0.43) FDPSSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL18994931 0.87 FDPS (0.41) FDPSSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL888737 0.86 LMNA (0.41) FDPSSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL10122823 0.86 LMNA (0.41) FDPSSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL12841633 0.86 FDPS (0.37) FDPSSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL8907899 0.85 FDPS (0.39) FDPSSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL19364781 0.83 LMNA (0.35) FDPSSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL25227617 0.78 KLK5 (0.43) FDPSITGA4ITGB7

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-2400846-B1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARM INC (US) 2016-10-05 EP disclosed