SCHEMBL23905709

SCHEMBL23905709

CC1(CF)COc2c1cc(C(O)(CNC(=O)c1cc(OC3CC3)c3ncccc3c1)C(F)(F)F)nc2-c1ccc(I)cc1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.30
HRH1 P35367 1/20 0.30
KCNH2 Q12809 1/20 0.30
PDE4D Q08499 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
SCHEMBL23905481 0.94 AR (0.34) HRH1KCNH2
SCHEMBL23905243 0.94 AR (0.34) HRH1KCNH2
SCHEMBL23905482 0.94 AR (0.34) HRH1KCNH2
SCHEMBL23905449 0.87 GABRA5 (0.33) HRH1KCNH2
SCHEMBL23905268 0.87 AR (0.34)
SCHEMBL24985122 0.86 AR (0.34)
SCHEMBL24985121 0.86 AR (0.34)
SCHEMBL23905260 0.85 AR (0.33)
SCHEMBL24984629 0.85 AR (0.33)
SCHEMBL24986142 0.85 GABRA5 (0.32) PDE4D

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