SCHEMBL29958677

SCHEMBL29958677

Cc1nccn1Cc1ccc(-c2cc(CC(C)C)ccc2S(N)(=O)=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 7/20 0.47
LMNA P02545 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
GRM2 Q14416 1/20 0.41
PIK3CA P42336 1/20 0.39
AGTR1 P30556 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
KCNH2 Q12809 1/20 0.35
FLT3 P36888 1/20 0.35
SYK P43405 1/20 0.35

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
SCHEMBL30970241 0.90 AGTR2 (0.41) AGTR2LMNAL3MBTL1GRM2PIK3CA
SCHEMBL23831146 0.88 AGTR2 (0.49) AGTR2KCNH2
SCHEMBL30195046 0.86 AGTR2 (0.44) AGTR2GRM2AGTR1CA12CA1
SCHEMBL23831166 0.85 AGTR2 (0.49) AGTR2KCNH2
SCHEMBL30194998 0.85 AGTR2 (0.48) AGTR2PIK3CA
SCHEMBL23831155 0.85 AGTR2 (0.52) AGTR2AGTR1CA12CA1CA2
SCHEMBL29958671 0.83 AGTR2 (0.58) AGTR2AGTR1
SCHEMBL23121085 0.81 AGTR2 (0.65) AGTR2AGTR1
SCHEMBL3528765 0.80 AGTR2 (0.62) AGTR2AGTR1
SCHEMBL30970242 0.79 CYP2D6 (0.49) AGTR2GRM2CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4313953-A1 SELECTIVE ANGIOTENSIN II RECEPTOR LIGANDS Vicore Pharma AB (SE) 2024-02-07 EP disclosed
CN-117222624-A Selective angiotensin II receptor ligands 维科尔药物公司 2023-12-12 CN disclosed
WO-2022200785-A1 SELECTIVE ANGIOTENSIN II RECEPTOR LIGANDS VICORE PHARMA AB (SE) 2022-09-29 WO disclosed