SCHEMBL23905694

SCHEMBL23905694

COc1cc(C(=O)NC[C@](O)(c2cc3c(c(-c4ccc(F)cc4)n2)OCC3(CF)CF)C(F)F)cc2cc(C(F)F)cnc12

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 2/20 0.31
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
ABCB1 P08183 1/20 0.30
ABCC1 P33527 1/20 0.30

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
SCHEMBL23905633 1.00 GABRA5 (0.31) GABRA5LMNATP53ABCB1ABCC1
SCHEMBL23905318 0.92 GABRA5 (0.32) GABRA5
SCHEMBL23904795 0.92 GABRA5 (0.32) GABRA5
SCHEMBL23905779 0.89
SCHEMBL23905292 0.87
SCHEMBL23904903 0.87 GABRA5 (0.31) GABRA5
SCHEMBL23905301 0.85 IP6K1 (0.31) GABRA5
SCHEMBL23905580 0.85 CFTR (0.32) GABRA5
SCHEMBL23905567 0.85 CFTR (0.32) GABRA5
SCHEMBL23905641 0.84 LMNA (0.33) GABRA5LMNATP53ABCB1ABCC1

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