SCHEMBL1532563

SCHEMBL1532563

O=C(NC1CCCCC1)Oc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 1.00
RAB9A P51151 1/20 1.00
FAAH O00519 2/20 0.76
EPHX1 P07099 1/20 0.70
LHCGR P22888 1/20 0.70

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
SCHEMBL21618461 1.00 ALDH1A1 (1.00) ALDH1A1RAB9AFAAHEPHX1LHCGR
SCHEMBL8393776 1.00 ALDH1A1 (1.00) ALDH1A1RAB9AFAAHEPHX1LHCGR
Bicarbonate SCHEMBL15226094 0.98 ALDH1A1 (0.97) ALDH1A1RAB9AFAAHEPHX1LHCGR
SCHEMBL5115600 0.98 ALDH1A1 (0.97) ALDH1A1RAB9AFAAHEPHX1LHCGR
SCHEMBL8395644 0.95 ALDH1A1 (0.90) ALDH1A1RAB9AFAAHEPHX1LHCGR
SCHEMBL9265423 0.94 ALDH1A1 (0.88) ALDH1A1RAB9AFAAHEPHX1LHCGR
SCHEMBL1890946 0.91 ALDH1A1 (0.83) ALDH1A1RAB9AFAAHEPHX1LHCGR
SCHEMBL1690686 0.91 ALDH1A1 (0.82) ALDH1A1RAB9AFAAHEPHX1LHCGR
SCHEMBL530169 0.87 FAAH (1.00) ALDH1A1RAB9AFAAHLHCGR
SCHEMBL10089405 0.87 ALDH1A1 (0.76) ALDH1A1RAB9AFAAHEPHX1LHCGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1616859-B1 Substituted cyclohexyl carboxylic acid compounds SEIKAGAKU KOGYO CO LTD (JP) 2013-09-04 EP claimed
US-20240308976-A1 COMPOUNDS THAT MEDIATE PROTEIN DEGRADATION AND USES THEREOF MONTE ROSA THERAPEUTICS AG (CH) 2024-09-19 US disclosed
CN-116947604-A Method for preparing 1, 4-cyclohexanediol from lignocellulose 北京林业大学 2023-10-27 CN disclosed
US-20230257357-A1 PROBENECID COMPOUNDS FOR THE TREATMENT OF INFLAMMASOME-MEDIATED LUNG DISEASE BACAINN BIOTHERAPEUTICS, LTD. (KY) 2023-08-17 US disclosed
CN-116035949-A Oil balance type low-turbidity high-compatibility cosmetic composition 上海永熙信息科技有限公司 2023-05-02 CN disclosed
WO-2023069708-A1 COMPOUNDS THAT MEDIATE PROTEIN DEGRADATION AND USES THEREOF MONTE ROSA THERAPEUTICS, INC. (US) 2023-04-27 WO disclosed
CN-112020493-B Method for producing urethane and method for producing isocyanate 旭化成株式会社 2023-04-21 CN disclosed
WO-2022005881-A1 PROBENECID COMPOUNDS FOR THE TREATMENT OF INFLAMMASOME-MEDIATED LUNG DISEASE BACAINN BIOTHERAPEUTICS, INC. (US) 2022-01-06 WO disclosed
CN-110546135-B Method for producing isocyanate 旭化成株式会社 2021-12-14 CN disclosed
CN-112020493-A Method for producing carbamate and method for producing isocyanate 旭化成株式会社 2020-12-01 CN disclosed
EP-2202220-A1 ACETYLENE COMPOUND, SALT THEREOF, CONDENSATE THEREOF, AND COMPOSITION THEREOF Fujifilm Corporation (JP) 2010-06-30 EP disclosed
US-20100009971-A1 Pyridyl Non-Aromatic Nitrogen-Containing Heterocyclic-1-Carboxylate Compound ASTELLAS PHARMA INC. (JP) 2010-01-14 US disclosed
US-20100009972-A1 Pyridyl Non-Aromatic Nitrogen-Containing Heterocyclic-1-Carboxylate Compound ASTELLAS PHARMA INC. (JP) 2010-01-14 US disclosed
US-20080306046-A1 Pyridyl Non-Aromatic Nitrogen-Containing Heterocyclic-1-Carboxylate Derivative FMC CORPORATION (US) 2008-12-11 US disclosed
CN-101160287-A Pyridyl non-aromatic nitrogenated heterocyclic-1-carboxylate ester derivative ASTELLAS PHARMA INC (JP) 2008-04-09 CN disclosed
EP-1849773-A1 PYRIDYL NON-AROMATIC NITROGENATED HETEROCYCLIC-1-CARBOXYLATE ESTER DERIVATIVE Astellas Pharma Inc. (JP) 2007-10-31 EP disclosed
US-5864043-A CARDIOVASCULAR DISORDERS AND ANGIOTENSIN ANTAGONIST KARL THOMAE GMBH (DE) 1999-01-26 US disclosed
US-5541229-A ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1996-07-30 US disclosed
US-4451406-A N-Substituted imido-dicarboxylic acid diaryl ester method of preparation BAYER AKTIENGESELLSCHAFT (DE) 1984-05-29 US disclosed
US-4447635-A N-Substituted imido-dicarboxylic acid diaryl ester compounds and herbicide intermediates BAYER AKTIENGESELLSCHAFT (DE) 1984-05-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230257357-A1 PROBENECID COMPOUNDS FOR THE TREATMENT OF INFLAMMASOME-MEDIATED LUNG DISEASE NLRP3, PYCARD, NLRP1 ALDH1A1 1247/4885RAB9A 2771/4885FAAH 2515/4885
US-20080306046-A1 Pyridyl Non-Aromatic Nitrogen-Containing Heterocyclic-1-Carboxylate Derivative FAAH, FAAH2, APEH ALDH1A1 113/4885RAB9A 2309/4885FAAH 1/4885
US-20100009972-A1 Pyridyl Non-Aromatic Nitrogen-Containing Heterocyclic-1-Carboxylate Compound FAAH, FAAH2, CNR2 ALDH1A1 133/4885RAB9A 1393/4885FAAH 1/4885
US-20240308976-A1 COMPOUNDS THAT MEDIATE PROTEIN DEGRADATION AND USES THEREOF CRBN, GSPT1, GSPT2 ALDH1A1 4088/4885RAB9A 1848/4885FAAH 3282/4885
US-20100009971-A1 Pyridyl Non-Aromatic Nitrogen-Containing Heterocyclic-1-Carboxylate Compound FAAH, FAAH2, CNR1 ALDH1A1 134/4885RAB9A 1416/4885FAAH 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.