SCHEMBL8003071

SCHEMBL8003071

CC1(C)C=Cc2cc(S(N)(=O)=O)ccc2O1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 17/20 0.49
EPAS1 Q99814 17/20 0.49
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
CYP3A4 P08684 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
CA7 P43166 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CA9 Q16790 1/20 0.43
CA13 Q8N1Q1 1/20 0.43
HSD17B10 Q99714 1/20 0.43
EP300 Q09472 1/20 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
SCHEMBL9196234 0.86 HIF1A (0.50) HIF1AEPAS1ALDH1A1HPGDKDM4E
SCHEMBL7835766 0.84 HIF1A (0.49) HIF1AEPAS1ALDH1A1HPGDKDM4E
SCHEMBL9201152 0.82 HIF1A (0.53) HIF1AEPAS1EP300
SCHEMBL9203941 0.81 HIF1A (0.57) HIF1AEPAS1EP300
SCHEMBL8813555 0.81 HIF1A (0.49) HIF1AEPAS1ALDH1A1EP300
SCHEMBL7837529 0.79 HIF1A (0.56) HIF1AEPAS1EP300
SCHEMBL9335695 0.77 HIF1A (0.53) HIF1AEPAS1EP300
SCHEMBL9293857 0.76 HIF1A (0.43) HIF1AEPAS1EP300
SCHEMBL7826382 0.76 HIF1A (0.50) HIF1AEPAS1ALDH1A1CA12CA1
SCHEMBL7826302 0.76 HIF1A (0.60) HIF1AEPAS1CA12CA9EP300

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000021957-A1 BENZOPYRANS HAVING POTASSIUM CHANNEL OPENING ACTIVITY NOVARTIS AG (CH) 2000-04-20 WO disclosed