SCHEMBL8794845

SCHEMBL8794845

Cc1[c]ccc(OCCCc2c[nH]cn2)c1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.36
HSD17B10 Q99714 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 2/20 0.30
HTT P42858 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
HRH3 Q9Y5N1 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
SCHEMBL8794688 0.84 KCNH2 (0.31) KCNH2
SCHEMBL4386386 0.80 KCNH2 (0.37) KCNH2SMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL8794267 0.80
SCHEMBL4392943 0.78
SCHEMBL4386239 0.78 KCNH2 (0.31) KCNH2HRH3
SCHEMBL4392036 0.77 KCNH2 (0.33) KCNH2HRH3
SCHEMBL27647098 0.74 PDIA6 (0.34) KCNH2SMN1; SMN2MEN1KMT2A
SCHEMBL4380966 0.74 NQO1 (0.45) KCNH2SMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL7987297 0.74 HRH3 (0.54) KCNH2HSD17B10SMN1; SMN2MEN1ALDH1A1
SCHEMBL4392060 0.73 ALDH1A1 (0.49) HSD17B10SMN1; SMN2ALDH1A1KMT2A

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-0760811-A1 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H 3? (ANT)AGONISTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1997-03-12 EP claimed
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