SCHEMBL8103466

SCHEMBL8103466

CN(CCCNCc1ccc2c(n1)N(C)c1ncccc1N2C)CCCNCc1ccc2c(n1)N(C)c1ncccc1N2C

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 15/20 0.38
CHRM4 P08173 2/20 0.35
CHRM5 P08912 2/20 0.35
CHRM1 P11229 2/20 0.35
CHRM3 P20309 2/20 0.35
TERT O14746 1/20 0.32
SCN8A Q9UQD0 1/20 0.32
TMEM97 Q5BJF2 1/20 0.32
SIGMAR1 Q99720 1/20 0.32

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
SCHEMBL7468021 0.91 CHRM2 (0.39) CHRM2SCN8A
SCHEMBL8103450 0.91 CHRM2 (0.42) CHRM2SCN8A
SCHEMBL7467923 0.89 CHRM2 (0.44) CHRM2SCN8A
SCHEMBL7473528 0.88 CHRM2 (0.35) CHRM2SCN8A
SCHEMBL8109283 0.76 MEN1 (0.31)
SCHEMBL8107605 0.72 HRH3 (0.37)
SCHEMBL9777419 0.70 CHRM2 (0.68) CHRM2SCN8ATMEM97SIGMAR1
SCHEMBL8103219 0.69 ADORA3 (0.39)
SCHEMBL8093773 0.69 CHRM2 (0.33) CHRM2SCN8A
SCHEMBL7468232 0.66 ADRA2A (0.33) CHRM3

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
US-6127369-A 5,10-dihydrodipyrido[2,3-b:2,3-e]pyrazin and 5,10-dihydrodipyrido[2,3-b:3,2-e]pyrazin compounds ADIR ET COMPAGNIE (FR) 2000-10-03 US claimed