SCHEMBL20496290

SCHEMBL20496290

[CH2]n1cc(C)c(C(=O)Nc2sc3c(c2C(N)=O)CC(C)(C)OC3(C)C)n1

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CFTR P13569 20/20 0.62

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
SCHEMBL16445061 0.83 CFTR (0.59) CFTR
SCHEMBL20496291 0.82 CFTR (0.64) CFTR
SCHEMBL20496292 0.81 CFTR (0.65) CFTR
SCHEMBL16445501 0.81 CFTR (0.69) CFTR
SCHEMBL20496295 0.81 CFTR (0.66) CFTR
SCHEMBL16445151 0.79 CFTR (0.61) CFTR
SCHEMBL18196096 0.78 CFTR (0.71) CFTR
SCHEMBL16445070 0.78 CFTR (0.58) CFTR
SCHEMBL16445901 0.77 CFTR (0.71) CFTR
SCHEMBL16450571 0.77 CFTR (0.81) CFTR

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
EP-3030568-B1 THIENO[2,3-C]PYRANS AS CFTR MODULATORS GALAPAGOS NV (BE) 2018-09-19 — — EP claimed
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