SCHEMBL7730304

SCHEMBL7730304

CCN(CC)c1ccc2c(F)c(C)c(=O)oc2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 14/20 0.68
KDM4E B2RXH2 10/20 0.68
HTT P42858 6/20 0.68
TDP1 Q9NUW8 4/20 0.68
GLA P06280 7/20 0.65
ATM Q13315 6/20 0.65
GAA P10253 2/20 0.65
KLK7 P49862 1/20 0.65
L3MBTL1 Q9Y468 6/20 0.61
CASP1 P29466 6/20 0.61
CASP7 P55210 6/20 0.61
HSD17B10 Q99714 6/20 0.61
HPGD P15428 6/20 0.61
CYP3A4 P08684 3/20 0.61
IGLV6-57 P01721 3/20 0.61
HIF1A Q16665 2/20 0.61
MAPK1 P28482 2/20 0.61
MAPT P10636 7/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
MEN1 O00255 7/20 0.59

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
SCHEMBL11296750 0.89 ALDH1A1 (0.78) ALDH1A1KDM4EHTTTDP1GLA
SCHEMBL12651890 0.85 ALDH1A1 (0.72) ALDH1A1KDM4EHTTTDP1GLA
SCHEMBL24861952 0.81 ALDH1A1 (0.71) ALDH1A1KDM4EHTTTDP1GLA
SCHEMBL24589860 0.81 ALDH1A1 (1.00) ALDH1A1KDM4EHTTTDP1GLA
SCHEMBL700677 0.81 ALDH1A1 (0.73) ALDH1A1KDM4EHTTTDP1GLA
SCHEMBL4390559 0.79 ALDH1A1 (1.00) ALDH1A1KDM4EHTTTDP1GLA
SCHEMBL24590082 0.79 ALDH1A1 (0.76) ALDH1A1KDM4EHTTTDP1GLA
SCHEMBL22501602 0.79 ALDH1A1 (0.76) ALDH1A1KDM4EHTTTDP1GLA
SCHEMBL21456977 0.79 ALDH1A1 (0.67) ALDH1A1KDM4EHTTTDP1GLA
SCHEMBL13869309 0.79 ALDH1A1 (0.86) ALDH1A1KDM4EHTTTDP1GLA

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-6406668-B1 DETECTORS WITH POLYMERS OF PHENOLIC GROUPS, ACTIVATION AND EMISSION DETECTION UNIVERSITY OF IOWA RESEARCH FOUNDATION 2002-06-18 US disclosed