SCHEMBL95181

SCHEMBL95181

[CH2]CCC(C)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.57
TAAR1 Q96RJ0 3/20 0.54
TRPA1 O75762 4/20 0.48
AOC3 Q16853 2/20 0.48

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
SCHEMBL5542279 0.87 GRIA4 (0.47) RIPK1TAAR1
SCHEMBL445672 0.86 RIPK1 (0.53) RIPK1TAAR1TRPA1AOC3
SCHEMBL3544757 0.86 RIPK1 (0.48) RIPK1TAAR1TRPA1AOC3
SCHEMBL6280516 0.85 RIPK1 (0.67) RIPK1TAAR1TRPA1AOC3
SCHEMBL6802734 0.85 RIPK1 (0.52) RIPK1TAAR1TRPA1AOC3
SCHEMBL3391511 0.83 RIPK1 (0.50) RIPK1TAAR1TRPA1AOC3
SCHEMBL17183685 0.83 RIPK1 (0.50) RIPK1TAAR1TRPA1AOC3
SCHEMBL3384721 0.83 RIPK1 (0.50) RIPK1TAAR1TRPA1AOC3
SCHEMBL10989395 0.83 RIPK1 (0.50) RIPK1TAAR1TRPA1AOC3
SCHEMBL5544471 0.82 LTA4H (0.44) RIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210277200-A1 MALONATES AND DERIVATIVES FOR IN-SITU FILMS ZEPHYROS, INC. 2021-09-09 US claimed
US-11015034-B2 Malonates and derivatives for in-situ films ZEPHYROS, INC. (US) 2021-05-25 US claimed
US-20190169396-A1 MALONATES AND DERIVATIVES FOR IN-SITU FILMS ZEPHYROS, INC. 2019-06-06 US claimed
CN-109476955-A Malonic esters and derivatives for in situ membranes 泽费罗斯股份有限公司 2019-03-15 CN claimed
CN-109069419-A Abuse resistant drugs composition G.L.制药有限责任公司 2018-12-21 CN claimed
WO-2017184986-A1 MALONATES AND DERIVATIVES FOR IN-SITU FILMS ZEPHYROS, INC. (US) 2017-10-26 WO claimed
CN-1738829-B New 2',5'-oligoadenylic acid analog SANKYO CO 2012-11-28 CN claimed
EP-0543919-B1 USE OF HETEROCYCLIC AMINO-ALCOHOL COMPOUNDS IN THE MANUFACTURE OF A MEDICAMENT FOR TREATMENT OF CNS DISEASES SEARLE & CO (US) 1996-04-10 EP claimed
EP-0543919-A1 USE OF HETEROCYCLIC AMINO-ALCOHOL COMPOUNDS FOR TREATMENT OF CNS DISEASES. SEARLE & CO (US) 1993-06-02 EP claimed
WO-1992003131-A1 USE OF HETEROCYCLIC AMINO-ALCOHOL COMPOUNDS FOR TREATMENT OF CNS DISEASES G.D. SEARLE & CO. (US) 1992-03-05 WO claimed
CN-111919291-B Power module 信越化学工业株式会社 2024-05-17 CN disclosed
CN-112204402-B Methods for enhancing binding and activity prediction based on machine learning and molecular modeling 斯坦福大学托管董事会 2024-05-03 CN disclosed
CN-110317453-B Organosilicon modified polyimide resin composition 信越化学工业株式会社 2024-02-13 CN disclosed
CN-113710637-B Preparation method of biaryl phosphine 日本化学工业株式会社 2023-10-24 CN disclosed
CN-115819773-B Preparation method of high-temperature-resistant benzyl silicone oil with narrow molecular weight distribution 浙江开化合成材料有限公司 2023-10-03 CN disclosed
US-4340737-A CNS AGENTS, HYPOTENSIVES, DIURETICS AND AGENTS FOR TREATMENT OF GLAUCOMA PFIZER INC. (US) 1982-07-20 US disclosed
US-4329467-A USED AS ANTIPSYCHOTICS, ANTIEMETICS, AND ANALGESICS HOFFMANN-LA ROCHE INC. (US) 1982-05-11 US disclosed
EP-0045171-A2 9-Amino-1-hydroxyoctahydrobenzo(c)quinolines and derivatives thereof PFIZER INC. (US) 1982-02-03 EP disclosed
US-4309545-A ANALGESICS, TRANQUILIZERS, ANTIEMETICS, DIURETICS, ANTICONVULSANTS, ANTIDIARRHEAL, ANTITUSSIVES AND IN THE TREATMENT OF GLAUCOMA PFIZER INC. (US) 1982-01-05 US disclosed
US-4260764-A ANALGESICS, TRANQUILIZERS PFIZER INC. (US) 1981-04-07 US disclosed