SCHEMBL20207326

SCHEMBL20207326

Cc1cnc([C@H](C)C(C)C)cn1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
APLNR P35414 9/20 0.32
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL18523078 1.00 APLNR (0.32) APLNRNPC1LMNAMAPTRAB9A
SCHEMBL23612822 1.00 APLNR (0.32) APLNRNPC1LMNAMAPTRAB9A
SCHEMBL30168086 0.80 NPC1 (0.36) NPC1LMNAMAPTRAB9ASMN1; SMN2
SCHEMBL179362 0.80 NPC1 (0.36) NPC1LMNAMAPTRAB9ASMN1; SMN2
SCHEMBL13094057 0.77 KDM4E (0.30) NPC1RAB9A
SCHEMBL16504272 0.77 KDM4E (0.30) NPC1RAB9A
SCHEMBL443397 0.77 KDM4E (0.30) NPC1RAB9A
SCHEMBL18530889 0.77 APLNR (0.32) APLNRNPC1LMNAMAPTRAB9A
SCHEMBL18254654 0.77 APLNR (0.32) APLNRNPC1LMNAMAPTRAB9A
SCHEMBL20204744 0.76 APLNR (0.35) APLNRNPC1LMNAMAPTRAB9A

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-2018097945-A1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC. (US) 2018-05-31 WO disclosed