SCHEMBL29700571

SCHEMBL29700571

CCc1nccn1Cc1ccc(-c2cc(CC(C)C)sc2S(=O)(=O)NC(=O)NCCC(F)(F)F)cc1F

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 20/20 0.50
CYP3A4 P08684 1/20 0.44

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
SCHEMBL23120747 1.00 AGTR2 (0.50) AGTR2CYP3A4
Trifluoroacetic Acid SCHEMBL23121244 0.97 AGTR2 (0.48) AGTR2CYP3A4
SCHEMBL29700607 0.93 AGTR2 (0.54) AGTR2CYP3A4
SCHEMBL23121204 0.93 AGTR2 (0.54) AGTR2CYP3A4
SCHEMBL27081932 0.92 AGTR2 (0.54) AGTR2CYP3A4
Trifluoroacetic Acid SCHEMBL23120721 0.92 AGTR2 (0.51) AGTR2CYP3A4
SCHEMBL23120855 0.92 AGTR2 (0.53) AGTR2CYP3A4
SCHEMBL23120888 0.91 AGTR2 (0.49) AGTR2CYP3A4
SCHEMBL23121148 0.90 AGTR2 (0.52) AGTR2CYP3A4
SCHEMBL29700575 0.90 AGTR2 (0.52) AGTR2CYP3A4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4031240-A1 NEW COMPOUNDS Vicore Pharma AB (SE) 2022-07-27 EP claimed
CN-114786774-A Novel compounds 维科尔药物公司 2022-07-22 CN claimed
EP-4031240-A1 NEW COMPOUNDS Vicore Pharma AB (SE) 2022-07-27 EP disclosed
CN-114786774-A Novel compounds 维科尔药物公司 2022-07-22 CN disclosed