SCHEMBL29770374

SCHEMBL29770374

COc1ccccc1Oc1c(Cl)nc(-c2ncccn2)nc1Cl

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DHPS P49366 14/20 0.58
▸ EDNRA P25101 6/20 0.46
▸ EDNRB P24530 2/20 0.46

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
SCHEMBL618135 1.00 DHPS (0.58) DHPSEDNRAEDNRB
SCHEMBL7795451 0.91 DHPS (0.53) DHPSEDNRAEDNRB
SCHEMBL1257596 0.90 DHPS (0.52) DHPSEDNRAEDNRB
SCHEMBL4064097 0.90 DHPS (0.74) DHPS
SCHEMBL3227293 0.90 DHPS (0.51) DHPSEDNRAEDNRB
SCHEMBL9423908 0.87 LMNA (0.55) DHPS
SCHEMBL7300009 0.86 DHPS (0.51) DHPSEDNRA
SCHEMBL4062097 0.86 DHPS (0.51) DHPSEDNRAEDNRB
SCHEMBL13430565 0.85 DHPS (0.43) DHPSEDNRAEDNRB
SCHEMBL7787027 0.85 EDNRA (0.53) DHPSEDNRAEDNRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119823052-A Preparation method of bosentan 致卓医药科技(北京)有限责任公司 2025-04-15 — — CN claimed
CN-114907275-A Preparation method of bosentan 武汉工程大学 2022-08-16 — — CN claimed
CN-119823052-B Preparation method of bosentan 致卓医药科技(北京)有限责任公司 2025-11-25 — — CN disclosed
CN-119823052-A Preparation method of bosentan 致卓医药科技(北京)有限责任公司 2025-04-15 — — CN disclosed
CN-119823052-A Preparation method of bosentan 致卓医药科技(北京)有限责任公司 2025-04-15 — — CN disclosed
CN-114605337-B Preparation method of high-purity bosentan 重庆医药高等专科学校 2024-03-12 — — CN disclosed
CN-114605337-B Preparation method of high-purity bosentan 重庆医药高等专科学校 2024-03-12 — — CN disclosed
CN-114907275-A Preparation method of bosentan 武汉工程大学 2022-08-16 — — CN disclosed
CN-114907275-A Preparation method of bosentan 武汉工程大学 2022-08-16 — — CN disclosed
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