SCHEMBL4581280

SCHEMBL4581280

c1ccc(CC2(Cc3ccccc3)CCCCC2)cc1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
OPRM1 P35372 3/20 0.43
OPRL1 P41146 3/20 0.43
GAA P10253 1/20 0.42
ALDH1A1 P00352 2/20 0.41
ADRB2 P07550 2/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
POLB P06746 1/20 0.39
OPRK1 P41145 1/20 0.39

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
SCHEMBL268688 1.00 MAOA (0.52) MAOAMAOBOPRM1OPRL1GAA
SCHEMBL1588016 1.00 MAOA (0.52) MAOAMAOBOPRM1OPRL1GAA
SCHEMBL8347115 0.98 MAOA (0.54) MAOAMAOBOPRM1OPRL1GAA
SCHEMBL156160 0.93 MAOA (0.54) MAOAMAOBOPRM1OPRL1GAA
Formamide SCHEMBL28694742 0.88 MAOA (0.47) MAOAMAOBOPRM1OPRL1GAA
SCHEMBL2864890 0.87 MAOA (0.50) MAOAMAOBOPRM1OPRL1GAA
SCHEMBL18114517 0.87 MAOA (0.45) MAOAMAOBOPRM1OPRL1GAA
SCHEMBL4896837 0.87 GAA (0.51) MAOAMAOBGAAALDH1A1KMT2A
SCHEMBL10602994 0.87 MAOA (0.50) MAOAMAOBOPRM1OPRL1GAA
SCHEMBL30613092 0.87 ALDH1A1 (0.41) MAOAMAOBOPRM1OPRL1GAA

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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119161290-A Chiral imide carboxylic acid double rhodium complex and preparation method and application thereof 兰州大学 2024-12-20 CN claimed
CN-116284692-A high-Tg hydrocarbon resin, resin composition for high-frequency copper-clad plate and preparation method and application thereof 四川东材科技集团股份有限公司 2023-06-23 CN claimed
US-5081282-A Bicyclo compounds, inhibitors of thromboxane activity NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1992-01-14 US claimed
US-5077309-A Thromboxane a2 antagonist NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1991-12-31 US claimed
US-5055582-A Process for preparing thromboxane A2 antagonists NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1991-10-08 US claimed
US-5028733-A Prostaglandins NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1991-07-02 US claimed
US-5025034-A Thromboxane inhibitors NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1991-06-18 US claimed
US-5006539-A Thromborane inhibitor NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1991-04-09 US claimed
US-4992563-A Benzopyran intermediates for use in manufacturing thromboxane A2 antagonists NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1991-02-12 US claimed
US-4945106-A Prostaglandins NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1990-07-31 US claimed
EP-0231078-B1 PROSTAGLANDINS NAT RES DEV (GB) 1990-04-25 EP claimed
EP-0082646-B1 PROSTAGLANDINS NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1989-11-15 EP claimed
US-4837234-A Prostaglandins NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1989-06-06 US claimed
US-4628061-A Prostaglandins NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1986-12-09 US claimed
US-4596823-A Prostaglandins NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1986-06-24 US claimed
EP-3530690-B1 PLASTICIZER COMPOSITION COMPRISING CYCLOHEXANE 1,4-DIESTER-BASED COMPOUND, AND RESIN COMPOSITION COMPRISING SAME LG CHEMICAL LTD (KR) 2025-10-29 EP disclosed
CN-119768164-A Pharmaceutical compounds for treating complement-mediated disorders 阿雷克森制药公司 2025-04-04 CN disclosed
EP-0230381-A2 Prostaglandin synthesis NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1987-07-29 EP disclosed
EP-0208755-A1 THROMBOXANE ANTAGONISTS IN THE TREATMENT OF HORMONE-DEPENDENT NEOPLASIAS. NAT RES DEV (GB) 1987-01-21 EP disclosed
WO-1986004234-A2 THROMBOXANE ANTAGONISTS IN THE TREATMENT OF HORMONE-DEPENDENT NEOPLASIAS NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1986-07-31 WO disclosed