SCHEMBL20188976

SCHEMBL20188976

Cc1cnc(CC=O)nc1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
CCR1 P32246 1/20 0.32
CCR5 P51681 1/20 0.32
CCR8 P51685 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
APLNR P35414 3/20 0.31
KDM4E B2RXH2 2/20 0.31
NOS3 P29474 1/20 0.30
NOS2 P35228 1/20 0.30

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
SCHEMBL3922703 0.76 APLNR (0.44) APLNR
SCHEMBL29956303 0.76 L3MBTL1 (0.32) KDM4E
SCHEMBL3407215 0.76 ALDH1A1 (0.39) KDM4E
SCHEMBL622632 0.72
SCHEMBL4033509 0.71 CCR1 (0.43) MAPTRAB9ACCR1CCR5CCR8
SCHEMBL18648926 0.71 CCR1 (0.39) CCR1CCR5CCR8HDAC6APLNR
SCHEMBL11702945 0.70
Hydrochloric Acid SCHEMBL247415 0.70 CCR1 (0.41) MAPTRAB9ACCR1CCR5CCR8
SCHEMBL2937160 0.69
SCHEMBL2175860 0.68 GABRA1 (0.32) KDM4E

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-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