SCHEMBL6558749

SCHEMBL6558749

CCc1ccc2c(c1)C(=NO)CC(C)(C)O2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.41
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 15/20 0.39
ALDH1A1 P00352 14/20 0.39
TDP1 Q9NUW8 5/20 0.39
GAA P10253 12/20 0.38
MEN1 O00255 6/20 0.38
KMT2A Q03164 6/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
LMNA P02545 5/20 0.37
ALOX12 P18054 3/20 0.37
TP53 P04637 2/20 0.37
HPGD P15428 4/20 0.37
GLA P06280 4/20 0.37
CASP1 P29466 2/20 0.37
HSD17B10 Q99714 2/20 0.37
CASP7 P55210 1/20 0.37
RAD52 P43351 1/20 0.36
NPC1 O15118 1/20 0.35

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
SCHEMBL6558746 1.00 MAPT (0.41) MAPTATML3MBTL1KDM4EALDH1A1
SCHEMBL6559530 0.81 KDM4E (0.49) MAPTATMKDM4EALDH1A1TDP1
SCHEMBL6559535 0.81 KDM4E (0.49) MAPTATMKDM4EALDH1A1TDP1
SCHEMBL6561065 0.79 MAPT (0.43) MAPTL3MBTL1KDM4EALDH1A1TDP1
SCHEMBL6561063 0.79 MAPT (0.43) MAPTL3MBTL1KDM4EALDH1A1TDP1
SCHEMBL6559503 0.78 MAPT (0.63) MAPTATML3MBTL1KDM4EALDH1A1
SCHEMBL7467920 0.78 ALDH1A1 (0.50) MAPTL3MBTL1KDM4EALDH1A1TDP1
SCHEMBL7467918 0.78 ALDH1A1 (0.50) MAPTL3MBTL1KDM4EALDH1A1TDP1
SCHEMBL6559505 0.77 KDM4E (0.61) MAPTKDM4EALDH1A1TDP1GAA
SCHEMBL6559504 0.77 KDM4E (0.61) MAPTKDM4EALDH1A1TDP1GAA

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