SCHEMBL18320952

SCHEMBL18320952

Cc1c(N)nnn1CC1CCCC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GRM2 Q14416 9/20 0.41
LMNA P02545 1/20 0.39
PKM P14618 1/20 0.39
PDE8B O95263 6/20 0.38
ADORA3 P0DMS8 1/20 0.37
ADORA2A P29274 1/20 0.37
ADORA2B P29275 1/20 0.37
ADORA1 P30542 1/20 0.37
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 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
SCHEMBL15937207 0.73 NPC1 (0.42) MEN1MAPTRAB9AKMT2ANPSR1
SCHEMBL17351856 0.72 NPC1 (0.41) MEN1MAPTRAB9AKMT2ANPSR1
SCHEMBL15937250 0.71 LMNA (0.40) MEN1MAPTRAB9AKMT2ANPSR1
SCHEMBL15937204 0.70 LMNA (0.53) MAPTKMT2ALMNA
SCHEMBL16833300 0.70 MEN1 (0.54) MEN1MAPTRAB9AKMT2ANPSR1
SCHEMBL15937247 0.69 LMNA (0.55) MAPTKMT2ALMNA
SCHEMBL17459025 0.69 PKM (0.54) MEN1MAPTRAB9AKMT2ANPSR1
SCHEMBL15243049 0.67 GRM2 (0.50) RAB9AGRM2PKMPDE8BADORA3
SCHEMBL6156218 0.67 PKM (0.48) MEN1MAPTRAB9AKMT2ANPSR1
SCHEMBL23130739 0.66 NPC1 (0.45) GRM2LMNA

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-2016202935-A1 GLUCOSE TRANSPORT INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-12-22 WO disclosed