SCHEMBL1610044

SCHEMBL1610044

CC1=C(C(=O)O)C(c2ccccc2Cl)C(C(=O)O)=C(COCCN)N1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 3/20 0.70
ADRA1A P35348 3/20 0.70
SLC6A3 Q01959 3/20 0.70
HTR1A P08908 2/20 0.70
ADRA2A P08913 2/20 0.70
CHRM1 P11229 2/20 0.70
DRD1 P21728 2/20 0.70
SLC6A2 P23975 2/20 0.70
OPRM1 P35372 2/20 0.70
DRD3 P35462 2/20 0.70
KCNH2 Q12809 2/20 0.70
ABCB11 O95342 2/20 0.70
ABCB1 P08183 2/20 0.70
ADORA3 P0DMS8 2/20 0.70
ADRB3 P13945 2/20 0.70
OPRK1 P41145 2/20 0.70
SCN5A Q14524 2/20 0.70
KCNK2 O95069 1/20 0.70
ADRB2 P07550 1/20 0.70
DRD2 P14416 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
SCHEMBL30669880 1.00 TBXA2R (0.70) TBXA2RADRA1ASLC6A3HTR1AADRA2A
Benzene SCHEMBL7444141 1.00 TBXA2R (0.70) TBXA2RADRA1ASLC6A3HTR1AADRA2A
SCHEMBL34462108 1.00 TBXA2R (0.70) TBXA2RADRA1ASLC6A3HTR1AADRA2A
SCHEMBL16634960 1.00 TBXA2R (0.70) TBXA2RADRA1ASLC6A3HTR1AADRA2A
Maleic Acid SCHEMBL6822788 0.95 TBXA2R (0.64) TBXA2RADRA1ASLC6A3HTR1AADRA2A
SCHEMBL2846047 0.93 CYP3A4 (0.75) TBXA2RADRA1ASLC6A3HTR1AADRA2A
SCHEMBL6299952 0.93 CYP3A4 (0.75) TBXA2RADRA1ASLC6A3HTR1AADRA2A
Benzene SCHEMBL3268864 0.93 ABCB11 (0.82) TBXA2RADRA1ASLC6A3HTR1AADRA2A
SCHEMBL30471867 0.93 ABCB11 (0.82) TBXA2RADRA1ASLC6A3HTR1AADRA2A
SCHEMBL3183503 0.93 ABCB11 (0.82) TBXA2RADRA1ASLC6A3HTR1AADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111110854-A Composition comprising a histamine release-promoting substance and an inhibitory compound 黄泳华 2020-05-08 CN claimed
CN-111097050-A Composition comprising fatty acid or derivative thereof and phenylpyridine derivative 黄泳华 2020-05-05 CN claimed
EP-1435954-B1 A PROCESS FOR THE PREPARATION OF HIGHlLY PUREAMLODIPINE BENZENESULFONATE LEK PHARMACEUTICALS (SI) 2010-01-13 EP claimed
WO-2007131759-A1 A PROCESS FOR THE PREPARATION OF AMLODIPINE BENZENESULFONATE LEK PHARMACEUTICALS D.D. (SI) 2007-11-22 WO claimed
EP-0599220-B1 A process for the preparation of amlodipine benzenesulphonate LEK TOVARNA FARMACEVTSKIH (SI) 1996-08-14 EP claimed
US-12005141-B2 Pharmaceutical solution of amlodipine LIQMEDS WORLDWIDE LIMITED (GB) 2024-06-11 US disclosed
CN-112955965-B Method for lowering blood pressure using dihydropyridine calcium channel blocker pharmaceutical compositions 阿斯利康(英国)有限公司 2024-04-09 CN disclosed
US-20230414591-A1 TOPICAL AMLODIPINE SALTS FOR THE TREATMENT OF ANORECTAL DISEASES TAVANTA THERAPEUTICS HUNGARY INCORPORATED (HU) 2023-12-28 US disclosed
US-20230330018-A1 PHARMACEUTICAL SOLUTION OF AMLODIPINE LIQMEDS WORLDWIDE LIMITED (GB) 2023-10-19 US disclosed
US-11766428-B2 Topical amlodipine salts for the treatment of anorectal diseases TAVANTA THERAPEUTICS HUNGARY INCORPORATED (HU) 2023-09-26 US disclosed
US-11723866-B2 Pharmaceutical solution of amlodipine LIQMEDS WORLDWIDE LIMITED (GB) 2023-08-15 US disclosed
US-20230181598-A1 FORMULATIONS AND METHODS OF TREATING COVID-19 AND PREVENTING INFECTION WITH SARS-CoV-2 CARRAIG SLAINTE LIMITED (IE) 2023-06-15 US disclosed
EP-1013275-A2 Method and compositions for treating hypertension, angina and other disorders using optically pure (-) amlodipine SEPRACOR, INC. (US) 2000-06-28 EP disclosed
EP-0599220-B1 A process for the preparation of amlodipine benzenesulphonate LEK TOVARNA FARMACEVTSKIH (SI) 1996-08-14 EP disclosed
US-5438145-A Process for the preparation of amlodipine benzenesulphonate LEK, TOVARNA FARMECEVTSKIH IN KEMICNIH IZDELKOV (SI) 1995-08-01 US disclosed
EP-0661970-A1 METHODS AND COMPOSITIONS FOR TREATING HYPERTENSION, ANGINA AND OTHER DISORDERS USING OPTICALLY PURE (-) AMLODIPINE SEPRACOR, INC. (US) 1995-07-12 EP disclosed
US-5389654-A 3-ethyl 5-methyl(±)2-[2-(N-tritylamino)ethoxymethyl]-4-(2-chlorophenyl)-1,4-dihydro-6-methyl-6-methyl-3,5-pyridinedicarboxylate LEK, TOVARNA, FARMACEVTSKIH IN KEMICNIH . . . (SI) 1995-02-14 US disclosed
EP-0661970-A4 METHODS AND COMPOSITIONS FOR TREATING HYPERTENSION, ANGINA AND OTHER DISORDERS USING OPTICALLY PURE (-) AMLODIPINE. SEPRACOR INC (US) 1994-12-16 EP disclosed
EP-0599220-A1 A process for the preparation of amlodipine benzenesulphonate LEK, tovarna farmacevtskih in kemicnih izdelkov, d.d. (SI) 1994-06-01 EP disclosed
WO-1993010779-A1 METHODS AND COMPOSITIONS FOR TREATING HYPERTENSION, ANGINA AND OTHER DISORDERS USING OPTICALLY PURE (-) AMLODIPINE SEPRACOR, INC. (US) 1993-06-10 WO 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-20230414591-A1 TOPICAL AMLODIPINE SALTS FOR THE TREATMENT OF ANORECTAL DISEASES APC, ANO2, SLC10A2 TBXA2R 1988/4885ADRA1A 707/4885SLC6A3 2895/4885
US-11723866-B2 Pharmaceutical solution of amlodipine GK, CACNA1C, CACNA1I TBXA2R 968/4885ADRA1A 215/4885SLC6A3 888/4885
US-12005141-B2 Pharmaceutical solution of amlodipine GK, CACNA1C, CACNA1I TBXA2R 968/4885ADRA1A 215/4885SLC6A3 888/4885
US-20230330018-A1 PHARMACEUTICAL SOLUTION OF AMLODIPINE GK, CACNA1C, CACNA1I TBXA2R 968/4885ADRA1A 215/4885SLC6A3 888/4885
US-11766428-B2 Topical amlodipine salts for the treatment of anorectal diseases APC, ANO2, SLC10A2 TBXA2R 1988/4885ADRA1A 707/4885SLC6A3 2895/4885
US-20230181598-A1 FORMULATIONS AND METHODS OF TREATING COVID-19 AND PREVENTING INFECTION WITH SARS-CoV-2 ACE2, ACE, NR3C2 TBXA2R 490/4885ADRA1A 335/4885SLC6A3 2765/4885

“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.