SCHEMBL19225890

SCHEMBL19225890

Cc1cc(C(=N)C(N)=O)c(NCC(=O)N2CCC[C@H]2C(=O)NC[C@H]2CC2(Cl)Cl)c(C)n1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 9/20 0.43
▸ F2 P00734 7/20 0.34
▸ DPP4 P27487 2/20 0.34
▸ PREP P48147 1/20 0.34
▸ PRSS1 P07477 2/20 0.33
▸ DPP8 Q6V1X1 1/20 0.32
▸ DPP7 Q9UHL4 1/20 0.32
▸ GAA P10253 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
SCHEMBL19225972 0.87 CFD (0.44) CFDF2PRSS1
SCHEMBL19226048 0.86 CFD (0.44) CFDDPP4PREP
SCHEMBL19225958 0.82 CFD (0.40) CFDF2DPP4PRSS1
SCHEMBL19225902 0.81 CFD (0.39) CFDF2DPP4PRSS1DPP8
SCHEMBL19233355 0.80 CFD (0.52) CFD
SCHEMBL19225883 0.80 F2 (0.42) CFDF2PREPPRSS1DPP8
SCHEMBL19225838 0.79 CFD (0.39) CFDF2DPP4PREPPRSS1
SCHEMBL19225891 0.79 DPP4 (0.41) CFDF2DPP4PREPPRSS1
SCHEMBL19225967 0.79 CFD (0.40) CFDF2PREPPRSS1
SCHEMBL19226064 0.79 CFD (0.40) CFDF2DPP4PREPPRSS1

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-2867225-B1 PYRROLIDINE DERIVATIVES AND THEIR USE AS COMPLEMENT PATHWAY MODULATORS NOVARTIS AG (CH) 2017-08-09 — — EP disclosed
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