SCHEMBL3612571

SCHEMBL3612571

CCC(C)[C@H](NC(=O)OCC(C)C)C(=O)N1CC[C@H]1C#N

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 16/20 0.48
PREP P48147 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL3604298 0.92 DPP4 (0.58) DPP4PREP
SCHEMBL3612579 0.84 CTSK (0.54) DPP4PREP
SCHEMBL14602196 0.81 DPP4 (0.62) DPP4PREP
SCHEMBL5644618 0.81 DPP4 (0.62) DPP4PREP
SCHEMBL3598519 0.81 SMN1; SMN2 (0.40) DPP4SMN1; SMN2
SCHEMBL5696186 0.78 DPP4 (0.58) DPP4PREP
SCHEMBL9003137 0.78 DPP4 (0.58) DPP4PREP
SCHEMBL5053509 0.78 DPP4 (0.58) DPP4PREP
SCHEMBL5696187 0.78 DPP4 (0.58) DPP4PREP
SCHEMBL3605568 0.78 DPP4 (0.58) DPP4PREP

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
US-8183280-B2 FAP inhibitors VANTIA LIMITED (GB) 2012-05-22 US disclosed
US-20100081701-A1 FAP inhibitors VANTIA LIMITED (GB) 2010-04-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100081701-A1 FAP inhibitors FAP, APC, SERPINB1 DPP4 256/4885PREP 81/4885SMN1; SMN2 2583/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.