SCHEMBL21343591

SCHEMBL21343591

CCC(C)C(C(=O)N1CC(C)C[C@H]1CC)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 17/20 0.34
DPP8 Q6V1X1 7/20 0.33
DPP7 Q9UHL4 6/20 0.33
PEPD P12955 1/20 0.32
DPP9 Q86TI2 6/20 0.32
FAP Q12884 2/20 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
SCHEMBL21897066 0.91 PEPD (0.35) PEPD
SCHEMBL19658043 0.85 DPP8 (0.34) DPP4DPP8DPP7DPP9FAP
SCHEMBL22534979 0.84 DPP4 (0.35) DPP4DPP8DPP7PEPDDPP9
SCHEMBL19658093 0.82 PIK3CD (0.43) DPP4DPP8DPP7PEPDDPP9
SCHEMBL15033782 0.82 PIK3CD (0.43) DPP4DPP8DPP7PEPDDPP9
SCHEMBL18994149 0.82 PEPD (0.33) DPP4PEPD
SCHEMBL19658165 0.81 PEPD (0.35) PEPD
SCHEMBL21142893 0.80 DPP4 (0.33) DPP4
SCHEMBL19658095 0.73 PEPD (0.37) PEPD
SCHEMBL15396012 0.72 PIK3CD (0.42) DPP4DPP8DPP7DPP9

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-10807990-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2020-10-20 US disclosed
US-20190276468-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2019-09-12 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 (2 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-20190276468-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SARS1 DPP4 136/4885DPP8 113/4885DPP7 246/4885
US-10807990-B2 Antiviral compounds MAVS, EIF2AK2, SARS1 DPP4 136/4885DPP8 113/4885DPP7 246/4885

“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.