SCHEMBL9344657

SCHEMBL9344657

CCOC(=O)C1CC(=O)c2ccccc2C1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.61
KMT2A Q03164 5/20 0.61
KDM4E B2RXH2 3/20 0.61
MAPT P10636 4/20 0.48
MAPK1 P28482 1/20 0.47
ATM Q13315 1/20 0.47
TSHR P16473 1/20 0.47
MEN1 O00255 3/20 0.46
HPGD P15428 2/20 0.46
GAA P10253 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL259951 0.86 ALDH1A1 (0.52) ALDH1A1KMT2AKDM4EMAPTTSHR
SCHEMBL30047263 0.86 ALDH1A1 (0.52) ALDH1A1KMT2AKDM4EMAPTTSHR
SCHEMBL15519819 0.83 KMT2A (0.56) ALDH1A1KMT2AKDM4EMAPTTSHR
SCHEMBL8911487 0.83 KMT2A (0.56) ALDH1A1KMT2AKDM4EMAPTTSHR
SCHEMBL15774873 0.82 KMT2A (0.64) ALDH1A1KMT2AKDM4EMAPTMAPK1
SCHEMBL9300629 0.80 ALDH1A1 (0.69) ALDH1A1KMT2AKDM4EMAPTMAPK1
SCHEMBL11200246 0.78 CYP1A2 (0.49) ALDH1A1MAPTMAPK1ATMTSHR
SCHEMBL15116647 0.78 ACHE (0.46) ALDH1A1MAPTTSHRHSD17B10
SCHEMBL490810 0.78 MAPT (0.70) ALDH1A1KMT2AKDM4EMAPTMAPK1
SCHEMBL31460799 0.78 MAPT (0.70) ALDH1A1KMT2AKDM4EMAPTMAPK1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5292768-A Compound effective as cerebral insufficiency improver SUNTORY LIMITED (JP) 1994-03-08 US disclosed
US-5288752-A Brain disorders SUNTORY LIMITED (JP) 1994-02-22 US disclosed
EP-0322248-B1 COMPOUNDS EFFECTIVE AGAINST CEREBRAL INSUFFICIENCY SUNTORY LIMITED (JP) 1993-08-04 EP disclosed
US-5179092-A Cognition activators SUNTORY LIMITED (JP) 1993-01-12 US disclosed
US-5057514-A Compounds effective as cerebral schemia treating agents SUNTORY LIMITED (JP) 1991-10-15 US disclosed
EP-0322248-A2 Compounds effective against cerebral insufficiency SUNTORY LIMITED (JP) 1989-06-28 EP disclosed