SCHEMBL8934788

SCHEMBL8934788

COc1c[nH]c(CC2CC3CCC2C3)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
PDE5A O76074 1/20 0.37
PDGFRB P09619 5/20 0.34
PDGFRA P16234 5/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
TP53 P04637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MCHR1 Q99705 1/20 0.33
OPRK1 P41145 4/20 0.32
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
NR1I2 O75469 1/20 0.31
HSD11B1 P28845 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
SCHEMBL28139905 0.66
SCHEMBL8934790 0.64 LMNA (0.43) LMNAPDGFRBPDGFRAKDM4EALDH1A1
Iodide SCHEMBL28806915 0.62 MAPK1 (0.32) PDE5A
SCHEMBL14770739 0.61 LMNA (0.36) LMNAKDM4EALDH1A1TP53NPSR1
SCHEMBL22272517 0.61 GRM1 (0.44) LMNAPDE5AKDM4EALDH1A1HSD17B10
SCHEMBL18379791 0.60 MCHR1 (0.37) LMNAKDM4EALDH1A1TP53NPSR1
SCHEMBL18714955 0.60 MCHR1 (0.37) LMNAKDM4EALDH1A1TP53NPSR1
SCHEMBL21466550 0.60 MCHR1 (0.37) LMNAKDM4EALDH1A1TP53NPSR1
SCHEMBL19055333 0.60 MCHR1 (0.37) LMNAKDM4EALDH1A1TP53NPSR1
SCHEMBL18379792 0.60 MCHR1 (0.37) LMNAKDM4EALDH1A1TP53NPSR1

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-1996029315-A2 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 (ANT)AGONISTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1996-09-26 WO claimed