SCHEMBL20201185

SCHEMBL20201185

CC(C)[C@H](C)c1ncc(F)cn1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
APLNR P35414 3/20 0.35
JAK2 O60674 5/20 0.33
JAK3 P52333 3/20 0.33

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
SCHEMBL2625465 0.79 PTGS1 (0.36) APLNRJAK2JAK3
SCHEMBL24080199 0.77 APLNR (0.55) APLNR
SCHEMBL18254144 0.76 APLNR (0.34) APLNRJAK2JAK3
SCHEMBL18254289 0.76 APLNR (0.34) APLNRJAK2JAK3
SCHEMBL18254311 0.76 APLNR (0.34) APLNRJAK2JAK3
SCHEMBL18254140 0.76 APLNR (0.34) APLNRJAK2JAK3
SCHEMBL219272 0.75 APLNR (0.33) APLNRJAK2JAK3
SCHEMBL219915 0.75 APLNR (0.41) APLNRJAK2JAK3
SCHEMBL12067749 0.75 APLNR (0.33) APLNRJAK2JAK3
SCHEMBL219540 0.75 APLNR (0.33) APLNRJAK2JAK3

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
WO-2018097944-A1 TRIAZOLE FURAN COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC. (US) 2018-05-31 WO disclosed