SCHEMBL17641844

SCHEMBL17641844

CC(=O)[C@@H]1CC(F)CN1C

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PIN1 Q13526 1/20 0.33
▸ DPP4 P27487 1/20 0.32
▸ DPP8 Q6V1X1 1/20 0.32
▸ DPP9 Q86TI2 1/20 0.32
▸ CHRM2 P08172 2/20 0.31
▸ CHRM4 P08173 2/20 0.31
▸ CHRM5 P08912 2/20 0.31
▸ CHRM1 P11229 2/20 0.31
▸ CHRM3 P20309 2/20 0.31
▸ PEPD P12955 1/20 0.31
▸ XPNPEP1 Q9NQW7 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ CHRNB2 P17787 1/20 0.30
▸ CHRNA3 P32297 1/20 0.30
▸ CHRNA4 P43681 1/20 0.30
▸ CHRNB3 Q05901 1/20 0.30
▸ CHRNA6 Q15825 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
SCHEMBL21515921 1.00 PIN1 (0.33) PIN1DPP4DPP8DPP9CHRM2
SCHEMBL8915827 1.00 PIN1 (0.33) PIN1DPP4DPP8DPP9CHRM2
SCHEMBL13165479 1.00 PIN1 (0.33) PIN1DPP4DPP8DPP9CHRM2
SCHEMBL17995266 0.83 ATM (0.38) PIN1DPP4DPP8DPP9PEPD
SCHEMBL19540491 0.83 ATM (0.38) PIN1DPP4DPP8DPP9PEPD
SCHEMBL22360773 0.83 ATM (0.38) PIN1DPP4DPP8DPP9PEPD
SCHEMBL755185 0.83 ATM (0.38) PIN1DPP4DPP8DPP9PEPD
SCHEMBL10140519 0.81 DPP4 (0.31) PIN1DPP4DPP8DPP9PEPD
SCHEMBL12861032 0.81 PIN1 (0.41) PIN1DPP4DPP8DPP9PEPD
SCHEMBL12860983 0.81 PIN1 (0.41) PIN1DPP4DPP8DPP9PEPD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170298097-A1 Peptide Derivatives and Uses Thereof NOSOPHARM (FR) 2017-10-19 — — US disclosed
EP-2400846-B1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARM INC (US) 2016-10-05 — — EP disclosed
WO-2016046409-A1 NOVEL PEPTIDE DERIVATIVES AND USES THEREOF NOSOPHARM (FR) 2016-03-31 — — WO 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-20170298097-A1 Peptide Derivatives and Uses Thereof VIP, IAPP, NGLY1 PIN1 462/4885DPP4 18/4885DPP8 62/4885

“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.

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