SCHEMBL3604300

SCHEMBL3604300

CCC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC[C@H]1C#N

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 12/20 0.58
CTSK P43235 2/20 0.51
CTSS P25774 1/20 0.51
CTSL P07711 1/20 0.50
CTSB P07858 1/20 0.50
PREP P48147 2/20 0.46
DPP8 Q6V1X1 2/20 0.46
DPP9 Q86TI2 2/20 0.46
DPP7 Q9UHL4 2/20 0.44
BACE1 P56817 1/20 0.44

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
SCHEMBL5696187 0.97 DPP4 (0.58) DPP4CTSKCTSSCTSLCTSB
SCHEMBL3605568 0.97 DPP4 (0.58) DPP4CTSKCTSSCTSLCTSB
SCHEMBL8301687 0.97 DPP4 (0.58) DPP4CTSKCTSSCTSLCTSB
SCHEMBL5696186 0.97 DPP4 (0.58) DPP4CTSKCTSSCTSLCTSB
SCHEMBL9003137 0.97 DPP4 (0.58) DPP4CTSKCTSSCTSLCTSB
SCHEMBL5053509 0.97 DPP4 (0.58) DPP4CTSKCTSSCTSLCTSB
SCHEMBL3612579 0.92 CTSK (0.54) DPP4CTSKCTSSCTSLCTSB
SCHEMBL5047656 0.89 DPP4 (0.53) DPP4CTSKCTSSCTSLCTSB
SCHEMBL5644618 0.85 DPP4 (0.62) DPP4PREPDPP8DPP9DPP7
SCHEMBL14602196 0.85 DPP4 (0.62) DPP4PREPDPP8DPP9DPP7

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 256/4885CTSK 170/4885CTSS 232/4885

“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.