SCHEMBL8167984

SCHEMBL8167984

CC(C)[C@H](NC(=O)NC1CCCC1)C(=O)N1CCC[C@H]1C(N)=O

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ ALDH1A1 P00352 1/20 0.55
▸ DPP4 P27487 3/20 0.45
▸ DPP8 Q6V1X1 1/20 0.44
▸ DPP9 Q86TI2 1/20 0.44
▸ CCR1 P32246 1/20 0.42
▸ ELANE P08246 4/20 0.42
▸ EPHX1 P07099 4/20 0.42
▸ KDM4E B2RXH2 1/20 0.40
▸ EPHX2 P34913 3/20 0.40

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
SCHEMBL8167988 0.84 DPP4 (0.45) DPP4DPP8DPP9ELANE
SCHEMBL3778456 0.83 DPP4 (0.49) DPP4DPP8DPP9ELANEKDM4E
SCHEMBL2756268 0.81 CYP3A4 (0.49) DPP4DPP8DPP9ELANE
SCHEMBL3268700 0.81 CYP3A4 (0.49) DPP4DPP8DPP9ELANE
SCHEMBL8161391 0.79 ELANE (0.43) DPP4DPP8DPP9ELANE
SCHEMBL8161377 0.78 DPP4 (0.45) DPP4DPP8DPP9ELANE
SCHEMBL8143604 0.77 CMA1 (0.53) ELANE
SCHEMBL8161374 0.77 CMA1 (0.53) ELANE
SCHEMBL10875429 0.74 TRHR (0.49) ELANE
SCHEMBL30798320 0.74 EPHA2 (0.43) DPP4DPP8DPP9ELANE

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
WO-2008095058-A1 HCV PROTEASE INHIBITORS TAIGEN BIOTECHNOLOGY CO. LTD. (TW) 2008-08-07 — — WO disclosed
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