SCHEMBL10063205

SCHEMBL10063205

CCCc1[nH]c2ccc(CC)cc2c(=O)c1C

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.50
KDM4E B2RXH2 1/20 0.50
NPC1 O15118 1/20 0.50
ALDH1A1 P00352 1/20 0.50
RAB9A P51151 1/20 0.50
GABRA1 P14867 2/20 0.48
GABRB2 P47870 2/20 0.48
HSD17B10 Q99714 2/20 0.43
TSHR P16473 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
DHODH Q02127 1/20 0.42
HTR1A P08908 1/20 0.41
HTR1D P28221 1/20 0.41
HTR1B P28222 1/20 0.41

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
SCHEMBL10063274 0.80 SMN1; SMN2 (0.42) SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A
SCHEMBL29018537 0.74 KIF11 (0.53) SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A
SCHEMBL13349837 0.74 POLB (0.40) SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A
SCHEMBL10063705 0.73 SIRT1 (0.54) SMN1; SMN2NPC1ALDH1A1RAB9AHSD17B10
SCHEMBL14922485 0.73 NPC1 (0.59) SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A
SCHEMBL10063269 0.73 KDM4E (0.51) SMN1; SMN2KDM4EALDH1A1GABRA1HSD17B10
SCHEMBL10063355 0.72 MAPT (0.46) SMN1; SMN2KDM4EALDH1A1RAB9AHSD17B10
SCHEMBL13071245 0.72 NPC1 (0.58) SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A
SCHEMBL2056350 0.71 LMNA (0.59) SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A
SCHEMBL5494899 0.71 KIF11 (0.62) SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A

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-1364951-B1 Triazoquinolone derivatives as pest controllers MEIJI SEIKA PHARMA CO LTD (JP) 2012-05-02 EP disclosed