SCHEMBL11538163

SCHEMBL11538163

NCCCC(CF)NC(=O)CN

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CPB2 Q96IY4 1/20 0.33
▸ DNM1 Q05193 1/20 0.33
▸ GSR P00390 1/20 0.31
▸ DPP4 P27487 1/20 0.31
▸ DPP8 Q6V1X1 1/20 0.31
▸ DPP9 Q86TI2 1/20 0.31
▸ DPP7 Q9UHL4 1/20 0.31
▸ FOLH1 Q04609 1/20 0.31
▸ SLC15A2 Q16348 1/20 0.31
▸ RNPEP Q9H4A4 1/20 0.31
▸ PLA2G2C Q5R387 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
SCHEMBL11532872 0.81 PLA2G2C (0.39) CPB2GSRDPP4DPP8DPP9
Bromide SCHEMBL11534772 0.75 DPP7 (0.41) GSRDPP4DPP8DPP9DPP7
SCHEMBL22341404 0.71 HPGDS (0.43) CPB2FOLH1SLC15A2
SCHEMBL27860271 0.71 FOLH1 (0.54) CPB2GSRFOLH1SLC15A2RNPEP
SCHEMBL2114736 0.71 FOLH1 (0.54) CPB2GSRFOLH1SLC15A2RNPEP
SCHEMBL2114733 0.71 FOLH1 (0.54) CPB2GSRFOLH1SLC15A2RNPEP
SCHEMBL10969000 0.70 DNM1 (0.45) DNM1DPP8DPP9DPP7PLA2G2C
SCHEMBL11190725 0.70 KDM4E (0.36) DNM1
SCHEMBL22387766 0.69 CTSK (0.39) CPB2GSRDPP4DPP8DPP9
SCHEMBL11512461 0.68 CTSC (0.37) CPB2GSRDPP4DPP8DPP9

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
US-4134918-A ENZYME INHIBITORS, ANTIBODY INHIBITORS MERRELL TORAUDE ET COMPAGNIE (FR) 1979-01-16 — — US disclosed
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