SCHEMBL19941111

SCHEMBL19941111

Cc1nn(C)c(C)c1[S+]([O-])N1CCC(Oc2ccc(Cl)cc2Cl)CC1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 19/20 0.61
PROKR1 Q8TCW9 19/20 0.61
NMT1 P30419 1/20 0.40

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
SCHEMBL19941243 0.83 FPR2 (0.60) FPR2PROKR1
SCHEMBL19941134 0.82 FPR2 (0.60) FPR2PROKR1
SCHEMBL19941046 0.81 FPR2 (0.60) FPR2PROKR1
SCHEMBL19941106 0.81 FPR2 (0.61) FPR2PROKR1
SCHEMBL19941281 0.80 FPR2 (0.61) FPR2PROKR1NMT1
SCHEMBL19941205 0.80 FPR2 (0.62) FPR2PROKR1
SCHEMBL19941110 0.79 FPR2 (0.61) FPR2PROKR1
SCHEMBL19941256 0.76 FPR2 (0.57) FPR2PROKR1
SCHEMBL19941288 0.76 FPR2 (0.57) FPR2PROKR1
SCHEMBL15548957 0.76 FPR2 (1.00) FPR2PROKR1

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-2855449-B1 SULFONYL PIPERIDINE DERIVATIVES AND THEIR USE FOR TREATING PROKINETICIN MEDIATED DISEASES TAKEDA PHARMACEUTICALS CO (JP) 2018-03-07 EP disclosed