SCHEMBL20207356

SCHEMBL20207356

FC(F)(F)c1ccccc1-n1c(NSCCc2ccc(Cl)cc2)nnc1-c1cccs1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
APLNR P35414 17/20 0.49
PTGS2 P35354 1/20 0.42
TSHR P16473 1/20 0.40
KDM4E B2RXH2 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL20207351 0.91 PTGS2 (0.48) APLNRPTGS2TSHRKDM4ESMN1; SMN2
SCHEMBL20180772 0.86 APLNR (0.39) APLNRTSHRNPSR1
SCHEMBL22537211 0.84 APLNR (0.70) APLNR
SCHEMBL20188046 0.82 APLNR (0.73) APLNR
SCHEMBL20187809 0.80 APLNR (0.60) APLNR
SCHEMBL20207348 0.77 APLNR (0.69) APLNRSMN1; SMN2
SCHEMBL20207275 0.77 APLNR (0.64) APLNR
SCHEMBL22537233 0.77 APLNR (0.57) APLNR
SCHEMBL20207583 0.77 APLNR (0.72) APLNR
SCHEMBL22537175 0.77 APLNR (0.72) APLNR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3541805-B1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC (US) 2020-10-14 EP disclosed
WO-2018097945-A1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC. (US) 2018-05-31 WO disclosed