SCHEMBL27665976

SCHEMBL27665976

CCC(=O)Oc1ccc2c(c1)C=CC(C)(C)O2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.47
▸ HPGD P15428 2/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ COXFA4 O00483 1/20 0.45
▸ HIF1A Q16665 7/20 0.44
▸ EPAS1 Q99814 5/20 0.44
▸ KDM4E B2RXH2 3/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ CA12 O43570 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ CA7 P43166 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ CA13 Q8N1Q1 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42

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
SCHEMBL4492932 0.86 ALDH1A1 (0.51) ALDH1A1HPGDCYP3A4TDP1COXFA4
SCHEMBL27700164 0.86 ALDH1A1 (0.44) ALDH1A1HPGDCYP3A4TDP1COXFA4
SCHEMBL6935054 0.76 HIF1A (0.43) ALDH1A1HPGDCYP3A4TDP1COXFA4
SCHEMBL9356382 0.76 PTGS1 (0.37) ALDH1A1HPGDHIF1AEPAS1KDM4E
SCHEMBL14139406 0.75 KMT2A (0.59) ALDH1A1COXFA4HIF1AEPAS1KDM4E
SCHEMBL27212207 0.75 ALDH1A1 (0.46) ALDH1A1HPGDCYP3A4TDP1COXFA4
SCHEMBL27502553 0.74 ALDH1A1 (0.43) ALDH1A1HPGDCYP3A4TDP1COXFA4
SCHEMBL2827569 0.73 HIF1A (0.54) COXFA4HIF1AEPAS1
SCHEMBL5308630 0.71 HIF1A (0.47) HIF1AEPAS1
SCHEMBL27665986 0.71 COXFA4 (0.57) ALDH1A1HPGDCYP3A4TDP1COXFA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101160301-B Aminoalkyl-amidomethyl-substituted 2- (4-sulfonylamino) -3-hydroxy-3, 4-dihydro-2H-chromen-6-yl derivatives and their use as potassium channel blockers SOLVAY PHARM BV 2012-03-28 — — CN disclosed
CN-100532375-C Amidomethyl-substituted 2-(4-sulfonylamino)-3-hydroxy-3,4-dihydro-2h-chromen-6-yl compounds, a process and intermediates for their production, and pharmaceutical containing the compound SOLVAY PHARM GMBH (DE) 2009-08-26 — — CN disclosed
CN-101160301-A Aminoalkyl-amidomethyl-substituted 2- (4-sulfonylamino) -3-hydroxy-3, 4-dihydro-2H-chromen-6-yl derivatives and their use as potassium channel blockers SOLVAY PHARM GMBH (DE) 2008-04-09 — — CN disclosed
CN-1894233-A Amidomethyl-substituted 2-(4-sulfonylamino)-3-hydroxy-3,4-dihydro-2h-chromen-6-yl compounds, a process and intermediates for their production, and pharmaceutical compositions containing them SOLVAY PHARM GMBH (DE) 2007-01-10 — — CN disclosed
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