SCHEMBL8800839

SCHEMBL8800839

COC(OC)C1(C)CC(=O)c2cc(S(=O)(=O)c3ccccc3)ccc2O1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
KDM4E B2RXH2 6/20 0.37
KLK7 P49862 1/20 0.37
ALDH1A1 P00352 5/20 0.36
GAA P10253 2/20 0.36
GLA P06280 1/20 0.36
HPGD P15428 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
HSD17B10 Q99714 1/20 0.36
EPHX2 P34913 2/20 0.36
EPHX1 P07099 1/20 0.35
HTR6 P50406 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
POLB P06746 1/20 0.34
ABCC9 O60706 2/20 0.34
MAOB P27338 1/20 0.33
PPIB P23284 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL8798562 0.79 ATM (0.44) MAPTL3MBTL1KDM4EKLK7ALDH1A1
SCHEMBL2783959 0.77 MAPT (0.63) MAPTKDM4EKLK7ALDH1A1GAA
SCHEMBL9206985 0.76 ABCC9 (0.42) MAPTKDM4EALDH1A1GAAHPGD
SCHEMBL2784597 0.76 MAOB (0.59) MAPTKDM4EALDH1A1GAAGLA
SCHEMBL8797759 0.74 MAOB (0.42) MAPTKDM4EKLK7ALDH1A1GAA
SCHEMBL8797874 0.72 KDM4E (0.48) MAPTKDM4EKLK7ALDH1A1GAA
SCHEMBL2953559 0.72 ALDH1A1 (0.56) MAPTKDM4EALDH1A1MAOB
SCHEMBL9198312 0.72 SMN1; SMN2 (0.34) L3MBTL1ALDH1A1HPGDHTR6SMN1; SMN2
SCHEMBL8796818 0.70 KDM4E (0.33) MAPTKDM4EALDH1A1GAAHPGD
SCHEMBL9208134 0.70 HIF1A (0.43) MAPTALDH1A1HTR6SMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0514942-B1 Novel benzopyran derivatives and processes for the preparation thereof KOREA RES INST CHEM TECH (KR) 1997-03-05 EP disclosed
US-5493029-A USEFUL IN TREATING ASTHMA AND HYPERTENSION KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1996-02-20 US disclosed
EP-0514935-B1 Novel benzopyran derivatives and processes for the preparation thereof KOREA RES INST CHEM TECH (KR) 1995-11-08 EP disclosed
US-5300511-A Spiro-benzopyran derivatives and useful for treating asthma and hypertension KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1994-04-05 US disclosed
US-5236935-A Hypotensive agents KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1993-08-17 US disclosed
EP-0514942-A1 Novel benzopyran derivatives and processes for the preparation thereof KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1992-11-25 EP disclosed
EP-0514935-A1 Novel benzopyran derivatives and processes for the preparation thereof KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1992-11-25 EP disclosed