SCHEMBL5236399

SCHEMBL5236399

Cn1c(CN)c(-c2ccccc2)c2cc(Cl)c(Cl)cc2c1=O

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 16/20 0.76
KCNA5 P22460 1/20 0.48
KCNH2 Q12809 1/20 0.48
TACR1 P25103 3/20 0.46

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
Hydrochloric Acid SCHEMBL5241438 0.99 DPP4 (0.74) DPP4KCNA5KCNH2TACR1
SCHEMBL5236105 0.87 DPP4 (0.59) DPP4KCNA5KCNH2TACR1
SCHEMBL5236388 0.87 DPP4 (0.70) DPP4KCNA5KCNH2TACR1
SCHEMBL5232770 0.86 DPP4 (1.00) DPP4KCNA5KCNH2TACR1
SCHEMBL7557740 0.86 DPP4 (0.90) DPP4KCNA5KCNH2
SCHEMBL5235134 0.86 DPP4 (0.57) DPP4KCNA5KCNH2TACR1
Hydrochloric Acid SCHEMBL5236916 0.85 DPP4 (0.88) DPP4KCNA5KCNH2
SCHEMBL5235622 0.84 DPP4 (0.72) DPP4KCNA5KCNH2TACR1
SCHEMBL5240203 0.81 DPP4 (0.73) DPP4KCNA5KCNH2
SCHEMBL5239427 0.81 DPP4 (0.79) DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1355886-B1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL (JP) 2007-07-11 EP disclosed