SCHEMBL7823129

SCHEMBL7823129

CN(c1ccc(C(F)(F)F)cc1)S(=O)(=O)c1ccc2c(c1)C=CC(C)(C)O2

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 18/20 0.51
EPAS1 Q99814 18/20 0.51
EP300 Q09472 1/20 0.43
SERPINE1 P05121 1/20 0.42
NR1H3 Q13133 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
SCHEMBL7821774 0.88 HIF1A (0.48) HIF1AEPAS1EP300NR1H3
SCHEMBL7819712 0.87 HIF1A (0.65) HIF1AEPAS1EP300
SCHEMBL7820331 0.85 HIF1A (0.48) HIF1AEPAS1EP300
SCHEMBL7826302 0.85 HIF1A (0.60) HIF1AEPAS1EP300
SCHEMBL7820055 0.83 HIF1A (0.60) HIF1AEPAS1EP300
SCHEMBL9201152 0.79 HIF1A (0.53) HIF1AEPAS1EP300
SCHEMBL7825817 0.77 HIF1A (0.49) HIF1AEPAS1EP300
SCHEMBL7766906 0.76 ALDH1A1 (0.42) HIF1AEPAS1
SCHEMBL7822894 0.76 HIF1A (0.57) HIF1AEPAS1EP300
SCHEMBL8813555 0.76 HIF1A (0.49) HIF1AEPAS1EP300

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0828733-B1 BENZOPYRANS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM NOVARTIS AG (CH) 2001-09-05 EP disclosed
US-5905156-A POTASSIUM CHANNEL ACTIVATORS AND BRONCHODILATORS NOVARTIS AG (CH) 1999-05-18 US disclosed