SCHEMBL23905889

SCHEMBL23905889

COc1cc(C(=O)NCC(c2cc3c(c(-c4ccc(F)cc4)n2)OCC3(CF)CF)C(F)(F)F)cc2sc(Br)nc12

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGFR P43088 3/20 0.33
LMNA P02545 1/20 0.31
TP53 P04637 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
SCHEMBL23905675 0.86 PTGFR (0.32) PTGFRLMNATP53
SCHEMBL23905985 0.85 PTGFR (0.31) PTGFRLMNATP53
SCHEMBL23905869 0.85 GABRA5 (0.32) PTGFRLMNATP53
SCHEMBL23904880 0.85 PTGFR (0.33) PTGFRLMNATP53
SCHEMBL23905547 0.85 LMNA (0.32) PTGFRLMNATP53
SCHEMBL23905672 0.85
SCHEMBL23905891 0.84 CFTR (0.32)
SCHEMBL23195701 0.83 BTK (0.31) LMNATP53
SCHEMBL23905797 0.82 PTGFR (0.32) PTGFRLMNATP53
SCHEMBL23905949 0.82 PTGFR (0.31) PTGFRLMNATP53

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