SCHEMBL645945

SCHEMBL645945

O[CH]CCOc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.58
ALDH1A1 P00352 2/20 0.58
RECQL P46063 1/20 0.58
TAAR1 Q96RJ0 1/20 0.52
PKM P14618 1/20 0.48
THRB P10828 1/20 0.47
HDAC1 Q13547 2/20 0.47
HDAC2 Q92769 2/20 0.47
HTR1B P28222 2/20 0.47
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
DRD2 P14416 1/20 0.47
DRD4 P21917 1/20 0.47

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
SCHEMBL8062980 0.78 MAPT (0.50) DRD2DRD4DRD3MTNR1AMTNR1B
SCHEMBL1252989 0.78 ALDH1A1 (0.59) KCNA3ALDH1A1RECQLTAAR1PKM
SCHEMBL4180525 0.78 KDM4E (0.61) ALDH1A1HDAC1DRD3
SCHEMBL9486653 0.77 KCNA3 (0.58) KCNA3ALDH1A1RECQLTAAR1PKM
Allylanisole SCHEMBL4737421 0.77 KCNA3 (0.58) KCNA3ALDH1A1RECQLTAAR1PKM
SCHEMBL4065850 0.77 KCNA3 (0.58) KCNA3ALDH1A1RECQLTAAR1PKM
SCHEMBL10371839 0.77 KCNA3 (0.58) KCNA3ALDH1A1RECQLTAAR1PKM
SCHEMBL1454209 0.77 KCNA3 (0.58) KCNA3ALDH1A1RECQLTAAR1PKM
SCHEMBL43677 0.77 KCNA3 (0.58) KCNA3ALDH1A1RECQLTAAR1PKM
SCHEMBL4993415 0.77 KCNA3 (0.58) KCNA3ALDH1A1RECQLTAAR1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0696599-B1 Water-soluble cyclodextrin derivatives having lipophilic substituents and process for preparing them CONSORTIUM ELEKTROCHEM IND (DE) 1999-12-01 EP claimed
US-5594125-A STABILIZERS, PROTECTIVE COATINGS, FINISHES, ADHESION PROMOTERS, PHASE TRANSFER AGENTS AND FLAVOR AND ODOR ENHANCERS; DRUGS, COSMETICS, AGRICULTURE; PAPER, LEATHER AND TEXTILES Consortium f ur elektrochemische Industrie GmbH (DE) 1997-01-14 US claimed
EP-0696599-A1 Water-soluble cyclodextrin derivatives having lipophilic substituents and process for preparing them Consortium für elektrochemische Industrie GmbH (DE) 1996-02-14 EP claimed
WO-2024143408-A1 HEAT TRANSFER FINS ON WHICH ADSORBENT PARTICLES ARE SUPPORTED, ADSORPTION-TYPE HEAT EXCHANGE MODULE HAVING SAID HEAT TRANSFER FINS, AND METHODS FOR MANUFACTURING THESE 日本エクスラン工業株式会社 2024-07-04 WO disclosed
EP-3778802-B1 PHOTOCURABLE INK COMPOSITION FOR INKJET PRINTING SAKATA INX CORP (JP) 2023-11-15 EP disclosed
CN-117043288-A Active energy ray-curable ink composition for inkjet 阪田油墨股份有限公司 2023-11-10 CN disclosed
CN-115551959-B Photo-curable ink composition for inkjet printing 阪田油墨股份有限公司 2023-10-24 CN disclosed
EP-3778801-B1 PHOTOCURABLE INK COMPOSITION FOR INKJET PRINTING SAKATA INX CORP (JP) 2023-10-18 EP disclosed
US-20230220225-A1 PHOTOCURABLE INKJET PRINTING INK COMPOSITION SAKATA INX CORPORATION (JP) 2023-07-13 US disclosed
WO-2023106096-A1 GAS BARRIER FILM AND PACKAGING MATERIAL DIC株式会社 2023-06-15 WO disclosed
WO-2023054597-A1 PHOTOSENSITIVE RESIN COMPOSITION, CURED PRODUCT, PARTITION WALL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND IMAGE DISPLAY DEVICE 三菱ケミカル株式会社 2023-04-06 WO disclosed
EP-1219680-A1 ULTRAVIOLET-CURABLE RESIN COMPOSITION Taiyo Ink Manufacturing Co. Ltd (JP) 2002-07-03 EP disclosed
US-6323235-B1 CARDIOVASCULAR DISORDERS, ANTIISCHEMIC AGENTS AND ENZYME INHIBITORS OHTAKE ATSUSHI (JP) 2001-11-27 US disclosed
US-6043264-A A THROMBOXANE A2 RECEPTOR ANTAGONIST FOR TREATING HYPERTENSION, THROMBOSIS, ISCHEMIC HEART DISEASES, CIRCULATORY DISEASES, ARTERIOSCLEROSIS, PLATELET FUNCTION DISORDER, HYPERLIPIDEMIA, NEPHRITIS OR ASTHMA TORAY INDUSTRIES, INC. (JP) 2000-03-28 US disclosed
EP-0696599-B1 Water-soluble cyclodextrin derivatives having lipophilic substituents and process for preparing them CONSORTIUM ELEKTROCHEM IND (DE) 1999-12-01 EP disclosed
CN-1148381-A Benzene-fused heterocyclic derivative and use thereof TORAY INDUSTRIES (JP) 1997-04-23 CN disclosed
US-5594125-A STABILIZERS, PROTECTIVE COATINGS, FINISHES, ADHESION PROMOTERS, PHASE TRANSFER AGENTS AND FLAVOR AND ODOR ENHANCERS; DRUGS, COSMETICS, AGRICULTURE; PAPER, LEATHER AND TEXTILES Consortium f ur elektrochemische Industrie GmbH (DE) 1997-01-14 US disclosed
EP-0751126-A1 BENZENE-FUSED HETEROCYCLIC DERIVATIVE AND USE OF THE SAME TORAY INDUSTRIES, INC. (JP) 1997-01-02 EP disclosed
EP-0696599-A1 Water-soluble cyclodextrin derivatives having lipophilic substituents and process for preparing them Consortium für elektrochemische Industrie GmbH (DE) 1996-02-14 EP disclosed
EP-0364958-A2 Electrocoating composition NIPPON PAINT CO., LTD. (JP) 1990-04-25 EP disclosed