SCHEMBL6559504

SCHEMBL6559504

COc1ccc2c(c1)/C(=N/O)CC(C)(C)O2

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 14/20 0.61
ALDH1A1 P00352 14/20 0.61
MAPT P10636 7/20 0.61
TDP1 Q9NUW8 2/20 0.61
GAA P10253 10/20 0.52
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
LMNA P02545 3/20 0.52
ALOX12 P18054 2/20 0.52
TP53 P04637 1/20 0.52
KLK7 P49862 1/20 0.46
HPGD P15428 4/20 0.45
GLA P06280 4/20 0.45
CASP1 P29466 2/20 0.45
HSD17B10 Q99714 2/20 0.45
CASP7 P55210 1/20 0.45
PPIB P23284 1/20 0.45
APP P05067 1/20 0.44
SNCA P37840 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43

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
SCHEMBL6559505 1.00 KDM4E (0.61) KDM4EALDH1A1MAPTTDP1GAA
SCHEMBL7830552 0.89 ALDH1A1 (0.49) KDM4EALDH1A1MAPTTDP1GAA
SCHEMBL6593237 0.89 ALDH1A1 (0.49) KDM4EALDH1A1MAPTTDP1GAA
SCHEMBL7467920 0.83 ALDH1A1 (0.50) KDM4EALDH1A1MAPTTDP1GAA
SCHEMBL7467918 0.83 ALDH1A1 (0.50) KDM4EALDH1A1MAPTTDP1GAA
SCHEMBL621021 0.82 KDM4E (0.44) KDM4EALDH1A1MAPTTDP1GAA
SCHEMBL621022 0.82 KDM4E (0.44) KDM4EALDH1A1MAPTTDP1GAA
SCHEMBL6559535 0.81 KDM4E (0.49) KDM4EALDH1A1MAPTTDP1GAA
SCHEMBL6559530 0.81 KDM4E (0.49) KDM4EALDH1A1MAPTTDP1GAA
SCHEMBL6603109 0.80 MAOB (0.60) KDM4EALDH1A1MAPTTDP1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0807629-B1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them AVENTIS PHARMA GMBH (DE) 2004-03-03 EP disclosed
US-6191164-B1 POTASSIUM CHANNEL MODULATORS; ANTIULCER AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 2001-02-20 US disclosed
EP-0807629-A1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1997-11-19 EP disclosed