SCHEMBL21758149

SCHEMBL21758149

COc1c(C(N)=O)ccc2c1C=CC(C)(C)O2

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 18/20 0.65
HSP90AA1 P07900 3/20 0.64

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
SCHEMBL21765950 0.87 HIF1A (0.67) HIF1AHSP90AA1
SCHEMBL21752804 0.87 HIF1A (0.70) HIF1AHSP90AA1
SCHEMBL30860405 0.87 HIF1A (0.70) HIF1AHSP90AA1
SCHEMBL31074346 0.86 HIF1A (0.65) HIF1AHSP90AA1
SCHEMBL18245334 0.80 HIF1A (0.82) HIF1AHSP90AA1
SCHEMBL16694830 0.79 HIF1A (0.52) HIF1AHSP90AA1
SCHEMBL18244767 0.79 HIF1A (1.00) HIF1AHSP90AA1
SCHEMBL16694242 0.79 HIF1A (1.00) HIF1AHSP90AA1
SCHEMBL16694336 0.79 HIF1A (1.00) HIF1AHSP90AA1
SCHEMBL18244769 0.79 HIF1A (0.80) HIF1AHSP90AA1

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
WO-2020040582-A1 NOVEL BENZOPYRAN DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS EFFECTIVE INGREDIENT 고려대학교 산학협력단 2020-02-27 WO disclosed
WO-2020040581-A1 NOVEL QUINOLINE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT 고려대학교 산학협력단 2020-02-27 WO disclosed