SCHEMBL17328675

SCHEMBL17328675

CCc1nnn(CC(N)=O)n1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.49
ATM Q13315 1/20 0.49
HSD17B10 Q99714 1/20 0.49
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.40
HTT P42858 1/20 0.40
CNR2 P34972 2/20 0.40
ALDH1A1 P00352 2/20 0.40
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KDM4E B2RXH2 2/20 0.36
SCN9A Q15858 1/20 0.35

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
SCHEMBL13104263 0.79 CNR2 (0.58) PKMATMHSD17B10LMNASMN1; SMN2
SCHEMBL14641240 0.77 HSD17B10 (0.79) PKMATMHSD17B10SMN1; SMN2HTT
SCHEMBL30595308 0.77 LMNA (0.49) PKMATMHSD17B10LMNASMN1; SMN2
SCHEMBL10737046 0.74 PKM (0.41) PKMATMHSD17B10CNR2
SCHEMBL4412024 0.73
SCHEMBL18839851 0.73 PKM (0.47) PKMATMHSD17B10LMNAHTT
SCHEMBL18839891 0.73 PKM (0.81) PKMATMHSD17B10HTTCNR2
SCHEMBL4413215 0.70 RECQL (0.42) PKMATMHSD17B10LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL3711535 0.69 LTA4H (0.42) PKMATMHSD17B10LMNASMN1; SMN2
SCHEMBL13127229 0.69 LTA4H (0.48) PKMATMHSD17B10ALDH1A1RAB9A

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-2627631-B1 PYRROLIDINONES AS METAP2 INHIBITORS MERCK PATENT GMBH (DE) 2015-12-16 EP claimed