SCHEMBL9852469

SCHEMBL9852469

CNCCOc1cc(=O)c1=O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 4/20 0.44
HTR1D P28221 2/20 0.43
KDM4E B2RXH2 5/20 0.41
ALDH1A1 P00352 4/20 0.41
TDP1 Q9NUW8 2/20 0.41
LMNA P02545 2/20 0.41
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
HRH1 P35367 2/20 0.39
SLC6A4 P31645 1/20 0.39

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
SCHEMBL7915503 0.75 CYP1A2 (0.42) KDM4EALDH1A1TDP1LMNAGAA
SCHEMBL1704134 0.72
SCHEMBL7908960 0.70 HTR1B (0.69) HTR1BHTR1DKDM4EALDH1A1TDP1
SCHEMBL14075752 0.66 KDM4E (0.43) HTR1BHTR1DKDM4EALDH1A1TDP1
SCHEMBL21776313 0.65 HRH1 (0.63) HTR1BHTR1DKDM4EALDH1A1TDP1
SCHEMBL6110598 0.65 L3MBTL4 (0.57) HTR1BHTR1DKDM4EALDH1A1TDP1
SCHEMBL12951415 0.65 MAPT (0.43) HTR1BHTR1DKDM4EALDH1A1TDP1
SCHEMBL23067907 0.64 HTR1B (0.49) HTR1BHTR1DKDM4EHRH1SLC6A4
SCHEMBL21595770 0.64 MAPT (0.56) KDM4EALDH1A1TDP1LMNAL3MBTL1
SCHEMBL21601457 0.64 HTR1B (0.49) HTR1BHTR1DKDM4EALDH1A1TDP1

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-0413343-A2 Furan derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-02-20 EP disclosed