SCHEMBL4663223

SCHEMBL4663223

CC1=NN(c2ccccc2)C(=O)C1CC(C)C

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CES2 O00748 12/20 0.68
LOX P28300 1/20 0.59
LOXL3 P58215 1/20 0.59
LOXL4 Q96JB6 1/20 0.59
LOXL2 Q9Y4K0 1/20 0.59
ALDH1A1 P00352 2/20 0.56
GFER P55789 1/20 0.56
LMNA P02545 2/20 0.51
HTT P42858 2/20 0.51
PKM P14618 1/20 0.51
MAPT P10636 2/20 0.50
NPC1 O15118 1/20 0.50
MAPK1 P28482 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
AGER Q15109 2/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 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
SCHEMBL26840374 0.88 CES2 (0.65) CES2LOXLOXL3LOXL4LOXL2
SCHEMBL26840379 0.88 CES2 (0.65) CES2LOXLOXL3LOXL4LOXL2
SCHEMBL13104005 0.81 CES2 (1.00) CES2LOXLOXL3LOXL4LOXL2
SCHEMBL4663174 0.80 CES2 (0.67) CES2LOXLOXL3LOXL4LOXL2
SCHEMBL6042079 0.80 CES2 (0.67) CES2LOXLOXL3LOXL4LOXL2
SCHEMBL25454224 0.79 CES2 (0.65) CES2LOXLOXL3LOXL4LOXL2
SCHEMBL5279293 0.79 CES2 (0.65) CES2LOXLOXL3LOXL4LOXL2
SCHEMBL22922974 0.79 CES2 (0.68) CES2LOXLOXL3LOXL4LOXL2
SCHEMBL19499378 0.79 CES2 (0.89) CES2LOXLOXL3LOXL4LOXL2
SCHEMBL6700291 0.78 CES2 (0.63) CES2LOXLOXL3LOXL4LOXL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE35801-E PYRAZOLONE DERIVATIVES MITSUBISHI CHEMICAL CORPORATION (JP) 1998-05-19 US claimed
EP-0208874-B1 PROPHYLACTIC AND THERAPEUTIC AGENT FOR CIRCULATORY DISORDERS MITSUBISHI KASEI CORPORATION (JP) 1993-03-24 EP claimed
US-4857542-A INHIBITOR AGAINST LIPID PEROXIDATION MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1989-08-15 US claimed
EP-0208874-A1 Prophylactic and therapeutic agent for circulatory disorders MITSUBISHI KASEI CORPORATION (JP) 1987-01-21 EP claimed
US-20230364059-A1 STABLE PHARMACEUTICAL COMPOSITION JIANGSU SIMCERE PHARMACEUTICAL CO., LTD. (CN) 2023-11-16 US disclosed
US-20210128529-A1 DRUG CONTAINING PYRAZOLONE DERIVATIVE NOBELPHARMA CO., LTD. (JP) 2021-05-06 US disclosed
CN-112118839-A Pyrazolone derivative-containing drug 耐贝医药株式会社 2020-12-22 CN disclosed
EP-3666270-A1 DRUG CONTAINING PYRAZOLONE DERIVATIVE Nobelpharma Co., Ltd. (JP) 2020-06-17 EP disclosed
EP-1793821-B1 PYRAZOLONE COMPOUNDS FOR TREATING CEREBROVASCULAR DISORDERS MITSUBISHI TANABE PHARMA CORP (JP) 2018-10-31 EP disclosed
US-10004720-B2 Agent for preventing and/or treating ophthalmologic diseases MITSUBISHI TANABE PHARMA CORPORATION (JP) 2018-06-26 US disclosed
EP-3321255-A1 NOVEL THERAPEUTIC AGENT FOR AMYOTROPHIC LATERAL SCLEROSIS (ALS) OR DISEASE ATTRIBUTABLE TO ALS Mitsubishi Tanabe Pharma Corporation (JP) 2018-05-16 EP disclosed
US-20170273949-A1 AGENT FOR PREVENTING AND/OR TREATING OPHTHALMOLOGIC DISEASES MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-09-28 US disclosed
EP-1553087-A1 PREVENTIVE AND/OR THERAPEUTIC DRUGS FOR INFLAMMATORY INTESTINAL DISEASES Mitsubishi Pharma Corporation (JP) 2005-07-13 EP disclosed
US-20050009896-A1 Particularly 3-methyl-1-phenyl-2-pyrazolin-5-one; thrombolytic agent, an anticoagulant and/or a platelet aggregation inhibitory agent such as a thromboxane synthetase inhibitor; for treating and/or preventing ischemic diseases which are safe and have few side effects MITSUBISHI TANABE PHARMA CORPORATION (JP) 2005-01-13 US disclosed
US-20040254234-A1 Medicament for prevention and/or therapy of arterial wall disorder MITSUBISHI PHARMA CORPORATION (JP) 2004-12-16 US disclosed
EP-1437137-A1 DRUGS COMPRISING COMBINATION OF ANTITHROMBOTIC AGENT WITH PYRAZOLONE DERIVATIVE Mitsubishi Pharma Corporation (JP) 2004-07-14 EP disclosed
US-RE35801-E PYRAZOLONE DERIVATIVES MITSUBISHI CHEMICAL CORPORATION (JP) 1998-05-19 US disclosed
EP-0208874-B1 PROPHYLACTIC AND THERAPEUTIC AGENT FOR CIRCULATORY DISORDERS MITSUBISHI KASEI CORPORATION (JP) 1993-03-24 EP disclosed
US-4857542-A INHIBITOR AGAINST LIPID PEROXIDATION MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1989-08-15 US disclosed
EP-0208874-A1 Prophylactic and therapeutic agent for circulatory disorders MITSUBISHI KASEI CORPORATION (JP) 1987-01-21 EP 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 (6 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-20170273949-A1 AGENT FOR PREVENTING AND/OR TREATING OPHTHALMOLOGIC DISEASES MITF, EYA3, AQP1 CES2 4863/4885LOX 969/4885LOXL3 1562/4885
US-20040254234-A1 Medicament for prevention and/or therapy of arterial wall disorder ADRB3, TNNI3, AGTR1 CES2 944/4885LOX 680/4885LOXL3 959/4885
US-20230364059-A1 STABLE PHARMACEUTICAL COMPOSITION SYMPK, CYP3A7, CYP3A5 CES2 1270/4885LOX 4605/4885LOXL3 4716/4885
US-20050009896-A1 Particularly 3-methyl-1-phenyl-2-pyrazolin-5-one; thrombolytic agent, an anticoagulant and/or a platelet aggregation inhibitory agent such as a thromboxane synthetase inhibitor; for treating and/or preventing ischemic diseases which are safe and have few side effects PLAT, PTGIS, SERPINC1 CES2 3502/4885LOX 426/4885LOXL3 1933/4885
US-20210128529-A1 DRUG CONTAINING PYRAZOLONE DERIVATIVE CYP11B2, CYP3A5, DPYD CES2 2886/4885LOX 3182/4885LOXL3 3719/4885
US-10004720-B2 Agent for preventing and/or treating ophthalmologic diseases MITF, EYA3, AQP1 CES2 4863/4885LOX 969/4885LOXL3 1562/4885

“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.