SCHEMBL19940760

SCHEMBL19940760

Cc1nn(C)c(C)c1[S+]([O-])N1CCC(Cc2ccc(Cl)cc2F)CC1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PROKR1 Q8TCW9 17/20 0.62
FPR2 P25090 16/20 0.62
CCR3 P51677 1/20 0.41
DRD2 P14416 1/20 0.35
HTR2A P28223 1/20 0.35
HRH1 P35367 1/20 0.35
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
TSHR P16473 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL19941063 0.78 FPR2 (0.61) PROKR1FPR2CCR3
SCHEMBL15548934 0.77 PROKR1 (1.00) PROKR1FPR2
SCHEMBL19941111 0.73 FPR2 (0.61) PROKR1FPR2
SCHEMBL19941205 0.72 FPR2 (0.62) PROKR1FPR2
SCHEMBL19941243 0.71 FPR2 (0.60) PROKR1FPR2
SCHEMBL19941046 0.69 FPR2 (0.60) PROKR1FPR2
SCHEMBL14935031 0.69 FPR2 (0.50) PROKR1FPR2CCR3HTR2AKMT2A
SCHEMBL19941256 0.68 FPR2 (0.57) PROKR1FPR2
SCHEMBL19941134 0.68 FPR2 (0.60) PROKR1FPR2
SCHEMBL19941281 0.68 FPR2 (0.61) PROKR1FPR2

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