SCHEMBL28801602

SCHEMBL28801602

CN(C)CC(=O)N1CCCC1NC=O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PREP P48147 5/20 0.42
▸ DPP4 P27487 10/20 0.40
▸ FAP Q12884 6/20 0.40
▸ DPP7 Q9UHL4 1/20 0.36
▸ HCRTR2 O43614 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.33
▸ CHRM2 P08172 1/20 0.32
▸ CHRM4 P08173 1/20 0.32
▸ CHRM5 P08912 1/20 0.32
▸ CHRM1 P11229 1/20 0.32
▸ CHRM3 P20309 1/20 0.32
▸ UTS2R Q9UKP6 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
SCHEMBL28826381 0.83 DPP4 (0.40) PREPDPP4FAP
SCHEMBL29091403 0.80 DPP4 (0.34) PREPDPP4FAPDPP7
SCHEMBL27857100 0.80 ALDH1A1 (0.39) PREPDPP4FAPDPP7
SCHEMBL27879615 0.80 PREP (0.35) PREPDPP4FAPDPP7HCRTR2
SCHEMBL19104795 0.79 SMN1; SMN2 (0.44) PREPDPP4FAPDPP7HCRTR2
SCHEMBL7408815 0.77 POLB (0.36) DPP4
SCHEMBL27879636 0.77 CHRM2 (0.37) PREPDPP4FAPCHRM2CHRM4
SCHEMBL27896393 0.76 GAA (0.43) KDM4ECHRM2CHRM4CHRM5CHRM1
SCHEMBL27879604 0.73 NAMPT (0.35) DPP4HCRTR2
SCHEMBL27896434 0.73 CYP3A4 (0.39) PREPDPP4FAPDPP7KDM4E

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
CN-102791693-B Hepatitis c virus inhibitors BRISTOL-MYERS SQUIBB CO. (US) 2016-04-13 — — CN claimed
CN-102791693-A Hepatitis c virus inhibitors BRISTOL MYERS SQUIBB CO 2012-11-21 — — CN claimed
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