SCHEMBL143063

SCHEMBL143063

ClN1C=Cc2ccccc2C1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.38
HSD17B3 P37058 1/20 0.37
PARP1 P09874 1/20 0.36
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30

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
SCHEMBL3069885 0.77 HDAC3 (0.43) HDAC3HSD17B3PARP1CA1CA2
SCHEMBL560847 0.74 HDAC3 (0.38) HDAC3HSD17B3PARP1CA1CA2
SCHEMBL4854749 0.74 HDAC3 (0.41) HDAC3HSD17B3PARP1CA1CA2
SCHEMBL2003169 0.74 HDAC3 (0.38) HDAC3HSD17B3PARP1CA1CA2
SCHEMBL11353696 0.74 HDAC3 (0.38) HDAC3HSD17B3PARP1CA1CA2
SCHEMBL30385312 0.74 HDAC3 (0.41) HDAC3HSD17B3PARP1CA1CA2
SCHEMBL13932579 0.74 HDAC3 (0.38) HDAC3HSD17B3PARP1CA1CA2
SCHEMBL1564351 0.74 HDAC3 (0.41) HDAC3HSD17B3PARP1CA1CA2
SCHEMBL29612167 0.74 HDAC3 (0.41) HDAC3HSD17B3PARP1CA1CA2
SCHEMBL6298168 0.74 HDAC3 (0.38) HDAC3HSD17B3PARP1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113278036-B Phenothiazine-containing iridium complex and preparation method and application thereof 赣南师范大学 2022-04-12 CN claimed
CN-113336799-B Dicyano-containing iridium complex and preparation method and application thereof 赣南师范大学 2022-04-12 CN claimed
CN-113336799-A Dicyano-containing iridium complex and preparation method and application thereof 赣南师范大学 2021-09-03 CN claimed
CN-113278036-A Phenothiazine-containing iridium complex and preparation method and application thereof 赣南师范大学 2021-08-20 CN claimed
CN-113072496-A Preparation method of isoquinoline-1-formamide compound 湖北工业大学 2021-07-06 CN claimed
CN-102875542-B Oxadiazole group-containing red-light emitting iridium complex, and preparation method and use thereof NANJING UNIVERSITY OF TECHNOLOGY 2015-07-01 CN claimed
CN-102875542-A Oxadiazole group-containing red-light emitting iridium complex, and preparation method and use thereof NANJING UNIVERSITY OF TECHNOLOGY 2013-01-16 CN claimed
US-7776888-B2 such as 3-[2-(2-methoxy-ethoxymethyl)-6-trifluoromethyl-pyridine-3-carbonyl]-1,5-dimethyl-8-oxa-bicyclo[3.2.1]oct-6-ene-2,4-dione, used for controlling undesired plant growth or weeds SYNGENTA CROP PROTECTION, INC. (US) 2010-08-17 US claimed
US-20060052247-A1 Novel herbicides SYNGENTA CROP PROTECTION, INC. 2006-03-09 US claimed
US-20240400555-A1 Compounds, Compositions and Methods for Attenuation of Mammalian Translation of C-MYC or N-MYC Proteins of the MYC Proto-Oncogene Family of BHLH Transcription Factors INITIAL THERAPEUTICS, INC. (US) 2024-12-05 US disclosed
WO-2024226875-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR ATTENUATION OF MAMMALIAN TRANSLATION OF C-MYC OR N-MYC PROTEINS OF THE MYC PROTO-ONCOGENE FAMILY OF BHLH TRANSCRIPTION FACTORS INITIAL THERAPEUTICS, INC. (US) 2024-10-31 WO disclosed
US-20240199609-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF SHP2 NOVARTIS AG (CH) 2024-06-20 US disclosed
US-11905283-B2 Compounds and compositions for inhibiting the activity of SHP2 NOVARTIS AG (CH) 2024-02-20 US disclosed
US-11495755-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2022-11-08 US disclosed
US-20030220498-A1 Iron catalyzed cross coupling reactions of aromatic compounds STUDIENGESELLSCHAFT KOHLE MBH (DE) 2003-11-27 US disclosed
WO-2003033617-A1 PHOSPHORESCENT COMPOUNDS AND DEVICES COMPRISING THE SAME UNIVERSAL DISPLAY CORPORATION (US) 2003-04-24 WO disclosed
US-20030072964-A1 Phosphorescent compounds and devices comprising the same TRUSTEES OF PRINCETON UNIVERSITY, THE 2003-04-17 US disclosed
EP-0970054-A1 1-(ISOQUINOLIN-1-YL)-4-(1-PHENYLMETHYL)PIPERAZINES; DOPAMINE RECEPTOR SUBTYPE SPECIFIC LIGANDS NEUROGEN CORPORATION (US) 2000-01-12 EP disclosed
US-6008352-A USEFUL IN TREATING PSYCHOTIC DISORDERS SUCH AS SCHIZOPHRENIA AND OTHER CENTRAL NERVOUS SYSTEM DISEASES NEUROGEN CORPORATION (US) 1999-12-28 US disclosed
WO-1998039301-A1 1-(ISOQUINOLIN-1-YL)-4-(1-PHENYLMETHYL)PIPERAZINES; DOPAMINE RECEPTOR SUBTYPE SPECIFIC LIGANDS NEUROGEN CORPORATION (US) 1998-09-11 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 (7 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-11905283-B2 Compounds and compositions for inhibiting the activity of SHP2 PTPN1, PTPN2, PTPN5 HDAC3 1272/4885HSD17B3 2910/4885PARP1 4454/4885
US-11495755-B2 Organic electroluminescent materials and devices RUVBL2, TERT, OR10J3 HDAC3 2592/4885HSD17B3 3274/4885PARP1 566/4885
US-20240400555-A1 Compounds, Compositions and Methods for Attenuation of Mammalian Translation of C-MYC or N-MYC Proteins of the MYC Proto-Oncogene Family of BHLH Transcription Factors MYCBP, MYC, MYCBP2 HDAC3 2217/4885HSD17B3 3052/4885PARP1 3576/4885
US-20030072964-A1 Phosphorescent compounds and devices comprising the same NUDC, ORC3, PAICS HDAC3 3227/4885HSD17B3 4795/4885PARP1 153/4885
US-20060052247-A1 Novel herbicides DDT, CYP4F11, CYP1B1 HDAC3 1878/4885HSD17B3 404/4885PARP1 4771/4885
US-20030220498-A1 Iron catalyzed cross coupling reactions of aromatic compounds ARRB1, RBX1, CYP4X1 HDAC3 728/4885HSD17B3 1854/4885PARP1 879/4885
US-20240199609-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF SHP2 PTPN1, PTPN2, PTPN5 HDAC3 1272/4885HSD17B3 2910/4885PARP1 4454/4885

“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.