SCHEMBL5058381

SCHEMBL5058381

N#CC=CC(NC(=O)O)C1CCCC1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 7/20 0.33
DPP8 Q6V1X1 2/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 1/20 0.32
CTSL P07711 1/20 0.31
CA12 O43570 2/20 0.30
CA1 P00915 2/20 0.30
CA2 P00918 2/20 0.30
MMP2 P08253 2/20 0.30
CA9 Q16790 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
SCHEMBL5062315 1.00 DPP4 (0.33) DPP4DPP8DPP9DPP7CTSL
SCHEMBL5058379 1.00 DPP4 (0.33) DPP4DPP8DPP9DPP7CTSL
SCHEMBL22372490 0.74 EPHX1 (0.38) CA12CA1CA2MMP2CA9
SCHEMBL22372489 0.74 EPHX1 (0.38) CA12CA1CA2MMP2CA9
SCHEMBL30830238 0.67 EPHX2 (0.30)
SCHEMBL2899303 0.66
SCHEMBL17218505 0.64 SHBG (0.32)
SCHEMBL17218507 0.64 SHBG (0.32)
SCHEMBL21460375 0.63 EPHX1 (0.41) CA12CA1CA2MMP2CA9
SCHEMBL21460376 0.63 EPHX1 (0.41) CA12CA1CA2MMP2CA9

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
EP-1966202-A1 HETEROARYL SUBSTITUTED PYRROLOÝ2,3-B¨PYRIDINES AND PYRROLOÝ2,3-B¨PYRIMIDINES AS JANUS KINASE INHIBITORS Incyte Corporation (US) 2008-09-10 EP disclosed
WO-2007070514-A1 HETEROARYL SUBSTITUTED PYRROLO[2,3-B]PYRIDINES AND PYRROLO[2,3-B]PYRIMIDINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION (US) 2007-06-21 WO disclosed