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SCHEMBL27424155

SCHEMBL27424155

CCCCC1=NC2(CCCC2)C(=O)N1Cc1ccc(-c2ccccc2S(=O)(=O)Nc2noc(C)c2C)c(CN(C)C(=O)C2(C)CC2)c1

nearest known ligand 0.76

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EDNRA P25101 5/20 0.76
▸ AGTR1 P30556 4/20 0.76
▸ AGTR2 P50052 2/20 0.51
▸ ACHE P22303 3/20 0.46
▸ LTB4R2 Q9NPC1 2/20 0.46
▸ EDNRB P24530 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
SCHEMBL25084359 0.94 AGTR1 (0.67) EDNRAAGTR1AGTR2ACHELTB4R2
SCHEMBL6540680 0.93 EDNRA (0.78) EDNRAAGTR1AGTR2ACHELTB4R2
SCHEMBL6539787 0.93 EDNRA (0.80) EDNRAAGTR1AGTR2ACHELTB4R2
SCHEMBL6541050 0.92 EDNRA (0.79) EDNRAAGTR1AGTR2ACHELTB4R2
SCHEMBL6540498 0.92 EDNRA (0.77) EDNRAAGTR1AGTR2ACHELTB4R2
SCHEMBL6539953 0.92 EDNRA (0.77) EDNRAAGTR1AGTR2ACHELTB4R2
SCHEMBL6540520 0.92 EDNRA (0.77) EDNRAAGTR1AGTR2ACHELTB4R2
SCHEMBL27541665 0.92 EDNRA (0.79) EDNRAAGTR1AGTR2ACHELTB4R2
SCHEMBL6540963 0.92 EDNRA (0.80) EDNRAAGTR1AGTR2ACHELTB4R2
SCHEMBL5791243 0.91 EDNRA (0.87) EDNRAAGTR1AGTR2ACHELTB4R2

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
EP-4393920-A1 AROMATIC RING-CONTAINING BIOLOGICAL ANTAGONIST, AND PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Hansoh Biomedical Co., Ltd. (CN) 2024-07-03 — — EP disclosed