SCHEMBL4014562

SCHEMBL4014562

NC(=O)Cc1ccc(C=O)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 13/20 0.46
EPAS1 Q99814 13/20 0.46
SIRT1 Q96EB6 1/20 0.39
CA2 P00918 1/20 0.35

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
SCHEMBL13962527 0.83 SIRT1 (0.38) HIF1AEPAS1SIRT1CA2
SCHEMBL4015670 0.78 SIRT1 (0.38) SIRT1CA2
SCHEMBL4015677 0.78 SIRT1 (0.38) SIRT1CA2
SCHEMBL17712572 0.75
SCHEMBL4018580 0.75 SIRT1 (0.36) SIRT1
SCHEMBL4018576 0.75 SIRT1 (0.36) SIRT1
SCHEMBL12571386 0.74 HIF1A (0.60) HIF1AEPAS1
SCHEMBL4558567 0.74 SMN1; SMN2 (0.49) HIF1AEPAS1
SCHEMBL4017941 0.74 SMN1; SMN2 (0.49) HIF1AEPAS1
SCHEMBL4017514 0.73 SIRT1 (0.32) SIRT1

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-2009015180-A2 NOVEL COMPOUNDS AND METHODS OF USING THEM SYNDAX PHARMACEUTICALS, INC. (US) 2009-01-29 WO disclosed