SCHEMBL19940734

SCHEMBL19940734

Cc1nn(C)c(C)c1SN1CCC(Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 14/20 0.60
PROKR1 Q8TCW9 14/20 0.60
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.39
KMT2A Q03164 1/20 0.39
RPS6KB1 P23443 1/20 0.38

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
SCHEMBL19940790 0.91 FPR2 (0.60) FPR2PROKR1ALDH1A1RPS6KB1
SCHEMBL19941210 0.79 FPR2 (0.59) FPR2PROKR1LMNAKMT2A
SCHEMBL19940816 0.78 FPR2 (0.60) FPR2PROKR1LMNA
SCHEMBL19941260 0.77 FPR2 (0.62) FPR2PROKR1LMNAKMT2A
SCHEMBL15549371 0.75 FPR2 (1.00) FPR2PROKR1LMNAKMT2A
SCHEMBL19941050 0.75 FPR2 (0.62) FPR2PROKR1LMNAKMT2A
SCHEMBL19941295 0.74 FPR2 (0.63) FPR2PROKR1ALDH1A1LMNAKMT2A
SCHEMBL19941231 0.72 FPR2 (0.60) FPR2PROKR1
SCHEMBL19941190 0.71 FPR2 (0.63) FPR2PROKR1
SCHEMBL19941118 0.71 FPR2 (0.63) 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