SCHEMBL463397

SCHEMBL463397

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nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 15/20 0.38
PIN1 Q13526 1/20 0.35
DPP8 Q6V1X1 2/20 0.35
DPP9 Q86TI2 2/20 0.35
DPP7 Q9UHL4 2/20 0.35
FAP Q12884 1/20 0.33
MME P08473 2/20 0.33
MMEL1 Q495T6 1/20 0.33
CYP3A4 P08684 1/20 0.32

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
SCHEMBL10195792 0.86 DPP4 (0.35) DPP4DPP8DPP9DPP7FAP
SCHEMBL3705644 0.85 DPP4 (0.44) DPP4PIN1MMEMMEL1CYP3A4
SCHEMBL8290320 0.84 CTSS (0.41) DPP4PIN1DPP8DPP9DPP7
SCHEMBL25075296 0.83 DPP4 (0.40) DPP4PIN1DPP8DPP9DPP7
SCHEMBL15103376 0.83 DPP4 (0.40) DPP4PIN1DPP8DPP9DPP7
SCHEMBL15108795 0.83 DPP4 (0.40) DPP4PIN1DPP8DPP9DPP7
SCHEMBL699083 0.82 DPP4 (0.39) DPP4PIN1DPP8DPP9DPP7
SCHEMBL699084 0.82 DPP4 (0.39) DPP4PIN1DPP8DPP9DPP7
SCHEMBL342707 0.81 DPP4 (0.43) DPP4PIN1
SCHEMBL342708 0.81 DPP4 (0.43) DPP4PIN1

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-20120220766-A1 TETRAHYDRO-IMIDAZO[1,5-alpha] PYRAZINE DERIVATIVES, PREPERATION PROCESS AND MEDICINAL USE THEREOF SHANGHAI HENGRUI PHARMACEUTICAL CO., LTD. (CN) 2012-08-30 US disclosed
US-20120065209-A1 TETRAHYDRO-IMIDAZO[1,5-a]PYRAZINE DERIVATIVES SALTS, PREPARATION METHODS AND MEDICINAL USE THEREOF SHANGHAI HENGRUI PHARMACEUTICAL CO., LTD. (CN) 2012-03-15 US disclosed
US-20080015146-A1 Dpp-IV Inhibitors SANTHERA PHARMACEUTICALS (DEUTSCHLAND) AG (DE) 2008-01-17 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 (3 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-20080015146-A1 Dpp-IV Inhibitors DPP4, DPP9, DPP3 DPP4 1/4885PIN1 353/4885DPP8 5/4885
US-20120220766-A1 TETRAHYDRO-IMIDAZO[1,5-alpha] PYRAZINE DERIVATIVES, PREPERATION PROCESS AND MEDICINAL USE THEREOF DPP4, DPP3, DPP7 DPP4 1/4885PIN1 146/4885DPP8 6/4885
US-20120065209-A1 TETRAHYDRO-IMIDAZO[1,5-a]PYRAZINE DERIVATIVES SALTS, PREPARATION METHODS AND MEDICINAL USE THEREOF DPP4, DPP7, DPP3 DPP4 1/4885PIN1 238/4885DPP8 4/4885

“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.