SCHEMBL23905830

SCHEMBL23905830

Cc1cc2cc(C(=O)NCC(O)(c3cc4c(c(-c5ccc(F)cc5)n3)OCC4(C)CF)C(F)(F)F)cc(OC3CC3)c2nn1

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CFTR P13569 3/20 0.31
GABRA5 P31644 1/20 0.31

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
SCHEMBL23905299 1.00 CFTR (0.31) CFTRGABRA5
SCHEMBL23905825 1.00 CFTR (0.31) CFTRGABRA5
SCHEMBL23905595 0.92 CFTR (0.34) CFTRGABRA5
SCHEMBL23905256 0.92 CFTR (0.34) CFTRGABRA5
SCHEMBL23904872 0.91 CFTR (0.31) CFTRGABRA5
SCHEMBL23905588 0.91 CFTR (0.31) CFTRGABRA5
SCHEMBL23904861 0.90 GABRA5 (0.31) GABRA5
SCHEMBL23905481 0.89 AR (0.34) CFTRGABRA5
SCHEMBL23905243 0.89 AR (0.34) CFTRGABRA5
SCHEMBL23905482 0.89 AR (0.34) CFTRGABRA5

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-2021198981-A1 ANTIVIRAL COMPOUNDS AND USES THEREOF Janssen Biopharma, Inc. (US) 2021-10-07 WO disclosed