SCHEMBL8425658

SCHEMBL8425658

COc1ccc(-c2cc(OC)c(OC)cc2C2=NC(C)(C)CO2)cc1OC

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.43
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 2/20 0.41
PDE4A P27815 1/20 0.41
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
CYP2D6 P10635 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
KIT P10721 1/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
TYK2 P29597 1/20 0.38
ADORA1 P30542 1/20 0.38
PDE4B Q07343 1/20 0.38

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
SCHEMBL7283163 0.88 LMNA (0.49) CYP19A1ALDH1A1KDM4EPDE4ALMNA
SCHEMBL2150715 0.82 KDM4E (0.44) ALDH1A1KDM4ELMNAMAPTHTT
SCHEMBL10420398 0.80 MAPT (0.43) ALDH1A1KDM4EMAPTHTTHPGD
SCHEMBL9997018 0.79 LMNA (0.46) KDM4ELMNAMAPTHTTCYP2D6
SCHEMBL5258630 0.78 KDM4E (0.42) ALDH1A1KDM4ELMNAMAPTHTT
SCHEMBL19002079 0.78 KDM4E (0.41) ALDH1A1KDM4ELMNAMAPTHTT
SCHEMBL11833922 0.78 KDM4E (0.41) ALDH1A1KDM4ELMNAMAPTHTT
SCHEMBL22053097 0.77 LMNA (0.47) KDM4ELMNAMAPTHTTCYP2D6
SCHEMBL7483930 0.76 ALDH1A1 (0.43) ALDH1A1KDM4EMAPTHPGD
SCHEMBL7474680 0.76 LMNA (0.55) ALDH1A1KDM4ELMNAMAPTHTT

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-5942641-A TREATMENT OF ALZHEIMER'S DISEASE, NERVOUS SYSTEM DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1999-08-24 US disclosed
EP-0655992-B1 FLUORENONE DERIVATIVES, PROCESS FOR PREPARING THE SAME AND CENTRAL OR PERIPHERAL NERVE DEGENERATION REPAIR AND PROTECTIVE AGENT OTSUKA PHARMA CO LTD (JP) 1998-11-04 EP disclosed
EP-0791570-A1 Fluorenone derivatives, process for preparing the same and central or peripheral nerve degeneration repair and protective agent OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-08-27 EP disclosed
CN-1110875-A Fluorenone derivatives, process for preparing the same and central or peripheral nerve degeneration repair and protective agent OTSUKA PHARMA CO LTD (JP) 1995-10-25 CN disclosed
EP-0655992-A1 FLUORENONE DERIVATIVES, PROCESS FOR PREPARING THE SAME AND CENTRAL OR PERIPHERAL NERVE DEGENERATION REPAIR AND PROTECTIVE AGENT OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-06-07 EP disclosed
WO-1995000468-A1 FLUORENONE DERIVATIVES, PROCESS FOR PREPARING THE SAME AND CENTRAL OR PERIPHERAL NERVE DEGENERATION REPAIR AND PROTECTIVE AGENT OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-01-05 WO disclosed