SCHEMBL20895848

SCHEMBL20895848

CCCCn1c(N2CCCC(N)C2)nc2c1c(=O)n(Cc1ncc3ccccc3c1C#N)c(=O)n2C

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 20/20 0.62
▸ CHRM1 P11229 3/20 0.59

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
SCHEMBL20895847 1.00 DPP4 (0.62) DPP4CHRM1
SCHEMBL12649743 0.94 DPP4 (0.65) DPP4CHRM1
SCHEMBL1772989 0.90 DPP4 (0.77) DPP4CHRM1
SCHEMBL1772988 0.90 DPP4 (0.77) DPP4CHRM1
SCHEMBL19154444 0.85 DPP4 (0.61) DPP4CHRM1
SCHEMBL19305097 0.85 DPP4 (0.65) DPP4CHRM1
SCHEMBL20895842 0.83 DPP4 (0.80) DPP4CHRM1
SCHEMBL20895841 0.83 DPP4 (0.80) DPP4CHRM1
SCHEMBL19154408 0.83 DPP4 (0.81) DPP4CHRM1
SCHEMBL20895835 0.83 DPP4 (0.81) DPP4CHRM1

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-2190434-B1 PURIN DERIVATIVES FOR USE IN THE TREATMENT OF FAP-RELATED DISEASES BOEHRINGER INGELHEIM INT (DE) 2019-04-17 — — EP claimed
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