SCHEMBL6593582

SCHEMBL6593582

Cc1cc(O)nc(-c2ccccc2OCc2ccccc2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 4/20 0.56
L3MBTL1 Q9Y468 3/20 0.56
LMNA P02545 3/20 0.56
KDM4E B2RXH2 2/20 0.56
MAPK1 P28482 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
TSHR P16473 1/20 0.56
MAPT P10636 2/20 0.48
HTT P42858 2/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
CASP1 P29466 1/20 0.48
KMT2A Q03164 1/20 0.48
ATM Q13315 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
HSD17B10 Q99714 1/20 0.48
PTGER1 P34995 4/20 0.47

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
SCHEMBL7377100 0.82 MAPT (0.60) L3MBTL1LMNAKDM4EMAPK1TDP1
SCHEMBL9566443 0.74 BRD4 (0.57) BRD4L3MBTL1MAPK1TDP1MAPT
SCHEMBL27032689 0.74 LMNA (0.51) LMNAMAPK1TSHRHTTMEN1
SCHEMBL7464316 0.73 BRD4 (0.59) BRD4L3MBTL1KDM4EMAPK1TDP1
SCHEMBL7939339 0.73 ALDH1A1 (0.51) LMNAKDM4ETDP1MAPTHTT
SCHEMBL9397429 0.72 BRD4 (0.59) BRD4L3MBTL1KDM4EMAPK1TDP1
SCHEMBL26013299 0.72 MAPT (0.63) BRD4L3MBTL1MAPK1TDP1MAPT
SCHEMBL29502771 0.70 MAPT (0.58) BRD4L3MBTL1MAPK1TDP1MAPT
SCHEMBL14813470 0.70 MAPT (0.58) BRD4L3MBTL1MAPK1TDP1MAPT
SCHEMBL659166 0.70 MAPT (0.50) BRD4L3MBTL1LMNAMAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0781766-B1 HETEROCYCLIC DERIVATIVE AND MEDICINE NIPPON SHINYAKU CO LTD (JP) 2004-03-31 EP disclosed
CN-1118454-C Heterocyclic derivative and medicine NIPPON SHINYAKU CO LTD (JP) 2003-08-20 CN disclosed
US-6191149-B1 DRUG FOR CEREBROVASCULAR DISEASE NIPPON SHINYAKU, CO., LTD. (JP) 2001-02-20 US disclosed
US-5945426-A PREVENT NEURONAL DEATH NIPPON SHINYAKU CO., LTD. (JP) 1999-08-31 US disclosed
EP-0781766-A1 HETEROCYCLIC DERIVATIVE AND MEDICINE NIPPON SHINYAKU COMPANY, LIMITED (JP) 1997-07-02 EP disclosed