SCHEMBL10934320

SCHEMBL10934320

CC(C#N)C(C)(C)C(=O)NP(N)(N)=O

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 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
SCHEMBL10935364 0.86 DPP4 (0.35) DPP4
SCHEMBL10934332 0.70 MEN1 (0.35)
SCHEMBL4016069 0.69 DPP4 (0.36) DPP4
SCHEMBL20564526 0.69 DPP4 (0.37) DPP4
SCHEMBL20565192 0.68 DPP4 (0.35) DPP4
SCHEMBL10935212 0.66 L3MBTL1 (0.39)
SCHEMBL10935140 0.64 MMP1 (0.32)
SCHEMBL31340041 0.62 SMN1; SMN2 (0.35) DPP4
SCHEMBL10934109 0.61 L3MBTL1 (0.37)
SCHEMBL10932926 0.61 CA2 (0.43)

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-4517003-A N-acyl phosphoric triamide urease inhibitors and urease inhibited urea based fertilizer compositions ALLIED CORPORATION (US) 1985-05-14 US disclosed