SCHEMBL7848655

SCHEMBL7848655

c1cnc(-c2cc3ncccc3o2)nc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.51
CHRM4 P08173 1/20 0.51
CHRM5 P08912 1/20 0.51
CHRM1 P11229 1/20 0.51
CHRM3 P20309 1/20 0.51
CHRNB2 P17787 2/20 0.44
CHRNA4 P43681 2/20 0.44
CYP19A1 P11511 1/20 0.41
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 2/20 0.38
TP53 P04637 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GRM4 Q14833 2/20 0.38

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
SCHEMBL28428414 0.90 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL7852033 0.81 GRM4 (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9430009 0.81 CYP1B1 (0.50) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL24776300 0.79 KDM4E (0.54) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4142273 0.77 MAOB (0.56) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL14542315 0.77 CHRM2 (0.46) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL17687570 0.76 CYP19A1 (0.64) CYP19A1ALDH1A1KDM4ENPC1RAB9A
SCHEMBL30528410 0.75 CHRM2 (0.45) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4723565 0.73 CHRNB2 (0.49) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL14811086 0.73 CHRNB2 (0.45) CHRM2CHRM4CHRM5CHRM1CHRM3

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
EP-1136493-A1 2-(Thienopyridinyl)pyrimidone, 2-(furopyridinyl)pyrimidone 2-(isoquinolinyl)pyrimidone, 2-(pyridoindolyl)pyrimidone and 2-(benzofuropyridinyl)pyrimidone derivatives SANOFI-SYNTHELABO (FR) 2001-09-26 EP disclosed