SCHEMBL14738745

SCHEMBL14738745

NC(=O)[CH]CN1CC[C@@H](F)C1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.35
DPP4 P27487 6/20 0.34
DPP8 Q6V1X1 2/20 0.34
DPP9 Q86TI2 1/20 0.34
DPP7 Q9UHL4 2/20 0.33
GRM2 Q14416 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
SCHEMBL14738063 1.00 SMN1; SMN2 (0.35) SMN1; SMN2DPP4DPP8DPP9DPP7
SCHEMBL4314187 0.91 L3MBTL1 (0.34) DPP4DPP8DPP9DPP7GRM2
SCHEMBL4327147 0.89 SMN1; SMN2 (0.37) SMN1; SMN2
SCHEMBL4333641 0.86 DPP4 (0.30) DPP4
SCHEMBL29659494 0.82 FGFR2 (0.34) SMN1; SMN2DPP4DPP8DPP9DPP7
SCHEMBL29659607 0.82 FGFR2 (0.34) SMN1; SMN2DPP4DPP8DPP9DPP7
SCHEMBL29659728 0.82 FGFR2 (0.34) SMN1; SMN2DPP4DPP8DPP9DPP7
SCHEMBL4320581 0.81 PDCD1 (0.35) SMN1; SMN2DPP4DPP7
SCHEMBL4316264 0.78 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL4327227 0.77 SMN1; SMN2 (0.37) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2763990-B1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2017-02-22 EP claimed
US-8658646-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LAROCHE INC. (US) 2014-02-25 US claimed
EP-2763990-B1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2017-02-22 EP disclosed
US-8658646-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LAROCHE INC. (US) 2014-02-25 US disclosed
US-20130059834-A1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN-LA ROCHE INC. 2013-03-07 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-20130059834-A1 PYRROLOPYRAZINE KINASE INHIBITORS SYK, ZAP70, JAK1 SMN1; SMN2 4803/4885DPP4 1636/4885DPP8 2346/4885

“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.