SCHEMBL92970

SCHEMBL92970

N#Cc1ccc(CO)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.58
CYP2A6 P11509 2/20 0.58
CA2 P00918 2/20 0.52
CA12 O43570 1/20 0.52
CA3 P07451 1/20 0.52
CA6 P23280 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
IDO1 P14902 2/20 0.50
CYP11B1 P15538 1/20 0.49
CYP11B2 P19099 1/20 0.49
SAE1 Q9UBE0 1/20 0.47
UBA2 Q9UBT2 1/20 0.47
HTT P42858 1/20 0.47
KCNJ1 P48048 1/20 0.47
KCNH2 Q12809 1/20 0.47
CYP19A1 P11511 1/20 0.47
MMP3 P08254 1/20 0.46
ENPP2 Q13822 1/20 0.46
ALDH1A1 P00352 1/20 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
SCHEMBL27707919 0.97 LOXL2 (0.56) LOXL2CYP2A6CA2CA12CA3
Hydrogen Sulfide SCHEMBL27473257 0.97 LOXL2 (0.56) LOXL2CYP2A6CA2CA12CA3
SCHEMBL31591073 0.93 SAE1 (0.56) LOXL2CYP2A6CA2CA12CA3
SCHEMBL12807987 0.93 MMP3 (0.58) LOXL2CYP2A6CA2CA12CA3
SCHEMBL3236728 0.93 MMP3 (0.58) LOXL2CYP2A6CA2CA12CA3
Phosphoric Acid SCHEMBL28852152 0.89 LOXL2 (0.48) LOXL2CYP2A6CA2CA12CA3
Ammonia Solution, Strong SCHEMBL3944504 0.89 LOXL2 (0.48) LOXL2CYP2A6CA2CA12CA3
SCHEMBL3233441 0.87 LTA4H (0.59) LOXL2CYP2A6IDO1CYP11B1CYP11B2
SCHEMBL17253336 0.87 CYP1B1 (0.47) LOXL2CYP2A6CA2CA12CA3
SCHEMBL3178059 0.87 MAOB (0.59) LOXL2CYP2A6CA2CA12CA3

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 1262 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119968367-A Novel heterocyclylphenylmethylamine derivatives, process for their preparation and their use for preventing, alleviating or treating multiple sclerosis 韩国科学技术研究院 2025-05-09 CN claimed
WO-2025053791-A1 ONE-POT GRAFTING OF POLYMERS FROM ALCOHOLS AND BIOMASSES NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2025-03-13 WO claimed
CN-116440926-B Modified ZnIn2S4/BiVO4Heterojunction between benzyl alcohol and CO2Application in photocatalytic carboxylation 重庆工商大学 2024-07-02 CN claimed
CN-112204024-B ERK inhibitor and application thereof 贝达药业股份有限公司 2024-03-29 CN claimed
WO-2024029638-A1 NOVEL HETEROCYCLYL-PHENYL-METHYLAMINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF FOR PREVENTION, ALLEVIATION, OR TREATMENT OF MULTIPLE SCLEROSIS 한국과학기술연구원 2024-02-08 WO claimed
CN-116555080-A Preparation method of hybrid ester compound containing oxazole ring 上海交通大学医学院附属仁济医院 2023-08-08 CN claimed
CN-116440926-A Modified ZnIn 2 S 4 /BiVO 4 Heterojunction between benzyl alcohol and CO 2 Application in photocatalytic carboxylation 重庆工商大学 2023-07-18 CN claimed
CN-113024530-B Isatin-1, 2, 4-oxadiazole compound and preparation method and application thereof 合肥工业大学 2023-07-18 CN claimed
CN-116102554-A Naphthalimide bicyclic compound, preparation method and application thereof 首都师范大学 2023-05-12 CN claimed
CN-115925675-A Psamaplin A derivative and preparation method and application thereof 中国海洋大学 2023-04-07 CN claimed
US-20020165232-A1 Substituted N, N-disubstituted cycloalkyl aminoalcohol compounds useful for inhibiting cholesteryl ester transfer protein activity SIKORSKI JAMES A (US) 2002-11-07 US claimed
US-20020165231-A1 Substituted N-heteroaryl-N-phenyl aminoalcohol compounds useful for inhibiting cholesteryl ester transfer protein activity SIKORSKI JAMES A (US) 2002-11-07 US claimed
EP-1115693-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL $i(TERTIARY)-HETEROALKYLAMINES USEFUL FOR INHIBITING CHOLESTERYL ESTER TRANSFER PROTEIN ACTIVITY Monsanto Company (US) 2001-07-18 EP claimed
US-6187945-B1 TRANSFORMING AN AMINOMETHYL GROUP OF A CYANOBENZYLAMINE COMPOUND INTO A HYDROXYMETHYL GROUP, A HALOMETHYL GROUP, OR AN ACYLOXYMETHYL GROUP BY DIAZOTIZATION AND HYDROXYLATION, HALOGENATION OR ACYLATION SHOWA DENKO K.K. (JP) 2001-02-13 US claimed
EP-1004574-A1 Process for producing cyanobenzyl compounds Showa Denko Kabushiki Kaisha (JP) 2000-05-31 EP claimed
WO-2000018721-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL TERTIARY-HETEROALKYLAMINES USEFUL FOR INHIBITING CHOLESTERYL ESTER TRANSFER PROTEIN ACTIVITY MONSANTO COMPANY (US) 2000-04-06 WO claimed
EP-0365328-B1 Pyridine derivatives ZENECA LTD (GB) 1996-04-03 EP claimed
EP-0237522-B1 PHARMACEUTICALLY ACTIVE DERIVATIVES OF TRYPTOPHAN AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ROTTA RESEARCH LABORATORIUM S.P.A. (IT) 1993-02-24 EP claimed
US-5053415-A Antiischemic, antiinflammatory, antiarthritic agents, cardiovascular disorders IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-10-01 US claimed
EP-0365328-A2 Pyridine derivatives ZENECA LIMITED (GB) 1990-04-25 EP claimed

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

For each of this compound's patents that has machine-readable text (2 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-20020165231-A1 Substituted N-heteroaryl-N-phenyl aminoalcohol compounds useful for inhibiting cholesteryl ester transfer protein activity CETP, LCAT, MTTP LOXL2 2440/4885CYP2A6 2117/4885CA2 4562/4885
US-20020165232-A1 Substituted N, N-disubstituted cycloalkyl aminoalcohol compounds useful for inhibiting cholesteryl ester transfer protein activity CETP, DBI, PLTP LOXL2 2705/4885CYP2A6 3085/4885CA2 4517/4885

“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.