SCHEMBL345616

SCHEMBL345616

OCCCOCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.58
LTA4H P09960 1/20 0.50
EPHX2 P34913 1/20 0.50
TDP1 Q9NUW8 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KDM4E B2RXH2 1/20 0.48
POLB P06746 1/20 0.48
HRH4 Q9H3N8 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
GBA1 P04062 2/20 0.46
UGCG Q16739 2/20 0.46
GBA2 Q9HCG7 2/20 0.46
NAAA Q02083 2/20 0.44
TEAD3 Q99594 1/20 0.44
CA1 P00915 3/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL25312129 0.96 TSHR (0.54) TSHRLTA4HEPHX2TDP1L3MBTL1
SCHEMBL10821588 0.96 TSHR (0.54) TSHRLTA4HEPHX2TDP1L3MBTL1
SCHEMBL21068659 0.96 TSHR (0.54) TSHRLTA4HEPHX2TDP1L3MBTL1
SCHEMBL23249922 0.96 TSHR (0.54) TSHRLTA4HEPHX2TDP1L3MBTL1
SCHEMBL9329658 0.96 TSHR (0.54) TSHRLTA4HEPHX2TDP1L3MBTL1
SCHEMBL30736988 0.94 TSHR (0.52) TSHRLTA4HEPHX2TDP1L3MBTL1
SCHEMBL17941033 0.94 L3MBTL1 (0.53) TSHRLTA4HEPHX2TDP1L3MBTL1
SCHEMBL18282346 0.94 TSHR (0.52) TSHRLTA4HEPHX2TDP1L3MBTL1
SCHEMBL96049 0.94 TSHR (0.56) TSHRLTA4HEPHX2TDP1L3MBTL1
SCHEMBL23378047 0.92 TSHR (0.50) TSHRLTA4HEPHX2TDP1L3MBTL1

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 1473 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295203-A1 METAL ORGANIC COMPOUNDS UMICORE AG & CO. KG (DE) 2023-09-21 US claimed
US-20230192736-A1 ORGANOMETALLIC COMPOUNDS UMICORE AG & CO. KG (DE) 2023-06-22 US claimed
EP-4126890-A1 ORGANOMETALLIC COMPOUNDS Umicore AG & Co. KG (DE) 2023-02-08 EP claimed
EP-4126889-A1 METAL ORGANIC COMPOUNDS Umicore AG & Co. KG (DE) 2023-02-08 EP claimed
CN-112553017-A Non-corrosive stove degreaser concentrate 艺康美国股份有限公司 2021-03-26 CN claimed
CN-102757320-B Method for preparing aliskiren intermediate SHANGHAI INST PHARM INDUSTRY 2015-02-18 CN claimed
CN-102757320-A Method for preparing aliskiren intermediate SHANGHAI INST PHARM INDUSTRY 2012-10-31 CN claimed
US-20070161828-A1 Production process of 3-alkoxy-1-propanols, and 3-alkoxy-1-propanols obtained by the production process SHOWA DENKO K.K. (JP) 2007-07-12 US claimed
CN-1918098-A Process for producing 3-alkoxy-1-propanol and 3-alkoxy-1-propanol obtained by the process SHOWA DENKO KK (JP) 2007-02-21 CN claimed
EP-1713754-A2 PRODUCTION PROCESS OF 3-ALKOXY-1-PROPANOLS, AND 3-ALKOXY-1-PROPANOLS OBTAINED BY THE PRODUCTION PROCESS SHOWA DENKO KABUSHIKI KAISHA (JP) 2006-10-25 EP claimed
WO-2005075392-A2 PRODUCTION PROCESS OF 3-ALKOXY-1-PROPANOLS, AND 3-ALKOXY-1-PROPANOLS OBTAINED BY THE PRODUCTION PROCESS SHOWA DENKO K.K. (JP) 2005-08-18 WO claimed
US-20020058017-A1 Hair cosmetic compositions KAO CORPORATION (JP) 2002-05-16 US claimed
EP-1190696-A2 Hair cosmetic compositions and use thereof Kao Corporation (JP) 2002-03-27 EP claimed
US-5726165-A HYPOGLYCEMIC AGENTS; DIETETICS; GASTROINTESTINAL DISORDERS SMITHKLINE BEECHAM P.L.C. (GB) 1998-03-10 US claimed
EP-0772585-A1 ARYLOXY AND ARYLTHIOPROPANOLAMINE DERIVATIVES USEFUL AS BETA 3-ADRENORECEPTOR AGONISTS AND ANTAGONISTS OF THE BETA 1 AND BETA 2-ADRENORECEPTORS AND PHARMACEUTICAL COMPOSITION THEREOF SMITHKLINE BEECHAM PLC (GB) 1997-05-14 EP claimed
WO-1996004234-A1 ARYLOXY ANDARYCTHIO PROPANOLAMINE DERIVATIVES USEFUL AS B3-ADRENORECEPTOR AGONISTS AND ANTAGONS OF THE B1 AND B2 ADRENORECEPTORS AND PHARMACEUTICAL COMPOSITION THEREOF SMITHKLINE BEECHAM PLC (GB) 1996-02-15 WO claimed
WO-1996004233-A1 ARYLOXY AND ARYLTHIOPROPANOLAMINE DERIVATIVES USEFUL AS BETA 3-ADRENORECEPTOR AGONISTS AND ANTAGONISTS OF THE BETA 1 AND BETA 2-ADRENORECEPTORS AND PHARMACEUTICAL COMPOSITION THEREOF SMITHKLINE BEECHAM PLC (GB) 1996-02-15 WO claimed
US-5300676-A Herbicidal fluorine-substituted alpha-(5-aryloxynaphthalen-1-yl-oxy)-propionic acid derivatives BAYER AKTIENGESELLSCHAFT (DE) 1994-04-05 US claimed
EP-0453842-A2 Fluor subsituted derivatives of alpha-(5-aryloxy-naphthalen-1-yloxy)propionic acid BAYER AG (DE) 1991-10-30 EP claimed
EP-0277538-A2 Optically active ester of 2-(4-(3,5-dichloro-2-pyridinyl-oxy)-phenoxy)-propionic acid-(3-benzyloxy-propyl), process for its preparation and its use as a herbicide BAYER AG (DE) 1988-08-10 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 (3 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-20230295203-A1 METAL ORGANIC COMPOUNDS SCO2, MLX, PYM1 TSHR 4643/4885LTA4H 1631/4885EPHX2 724/4885
US-20020058017-A1 Hair cosmetic compositions FHIT, MITF, HNMT TSHR 2683/4885LTA4H 2584/4885EPHX2 1438/4885
US-20070161828-A1 Production process of 3-alkoxy-1-propanols, and 3-alkoxy-1-propanols obtained by the production process ADH1A, ADH5, ADH1C TSHR 2348/4885LTA4H 753/4885EPHX2 2202/4885

“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.