SCHEMBL20188474

SCHEMBL20188474

C[C@@H](Cc1ncc(Br)cn1)S(=O)(=O)Cl

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
APLNR P35414 5/20 0.35
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL20200283 1.00 APLNR (0.35) APLNRNPC1RAB9AKDM4E
SCHEMBL20188472 1.00 APLNR (0.35) APLNRNPC1RAB9AKDM4E
SCHEMBL20190471 0.84 APLNR (0.40) APLNRKDM4E
SCHEMBL20188717 0.82 APLNR (0.35) APLNRNPC1RAB9AKDM4E
SCHEMBL20188719 0.82 APLNR (0.35) APLNRNPC1RAB9AKDM4E
SCHEMBL20190068 0.78 APLNR (0.39) APLNRNPC1RAB9AKDM4E
SCHEMBL20189305 0.78 APLNR (0.39) APLNRNPC1RAB9AKDM4E
SCHEMBL20189301 0.78 APLNR (0.39) APLNRNPC1RAB9AKDM4E
SCHEMBL2629015 0.74 KDM4E (0.39) NPC1RAB9AKDM4E
SCHEMBL20181306 0.69 APLNR (0.36) APLNRNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3541792-B1 TRIAZOLE FURAN COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC (US) 2020-12-23 EP disclosed
EP-3541792-A1 TRIAZOLE FURAN COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR Amgen Inc. (US) 2019-09-25 EP disclosed
WO-2018097944-A1 TRIAZOLE FURAN COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC. (US) 2018-05-31 WO disclosed
WO-2018097944-A1 TRIAZOLE FURAN COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC. (US) 2018-05-31 WO disclosed