SCHEMBL7188435

SCHEMBL7188435

CCCCCCCCCCCCCCCCCCn1c(N)cc(=O)[nH]c1=S

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.56
MTNR1B P49286 1/20 0.56
GAA P10253 2/20 0.51
MAPK1 P28482 1/20 0.51
MAPK10 P53779 1/20 0.49
GPR84 Q9NQS5 1/20 0.44
HTT P42858 1/20 0.44
HPGD P15428 2/20 0.43
ALDH1A1 P00352 2/20 0.42
POLB P06746 1/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.41
ABL1 P00519 1/20 0.41
RIN1 Q13671 1/20 0.41
PNP P00491 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
SCN9A Q15858 2/20 0.40
SCN5A Q14524 1/20 0.40
ADORA2B P29275 1/20 0.40

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
SCHEMBL7187029 1.00 MTNR1A (0.56) MTNR1AMTNR1BGAAMAPK1MAPK10
SCHEMBL562714 0.98 MTNR1A (0.57) MTNR1AMTNR1BGAAMAPK1MAPK10
SCHEMBL1319862 0.84 KMT2A (0.55) MTNR1AMTNR1BMAPK10GPR84HTT
SCHEMBL4809763 0.84 KMT2A (0.55) MTNR1AMTNR1BMAPK10GPR84HTT
SCHEMBL7179000 0.84 KMT2A (0.55) MTNR1AMTNR1BMAPK10GPR84HTT
SCHEMBL9379061 0.83 MAPK10 (0.50) GAAMAPK10GPR84HTTALDH1A1
SCHEMBL1713239 0.83 KMT2A (0.56) MTNR1AMTNR1BGAAGPR84HTT
SCHEMBL1960768 0.81 GAA (0.56) MTNR1AMTNR1BGAAMAPK1HTT
SCHEMBL1945172 0.78 KMT2A (0.58) MTNR1AMTNR1BGAAGPR84HPGD
SCHEMBL1959222 0.77 GAA (0.53) MTNR1AMTNR1BGAAMAPK1HTT

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-1318168-A1 Stabiliser combinations for chlorinated polymers Crompton Vinyl Additives GmbH (DE) 2003-06-11 EP disclosed