SCHEMBL5798484

SCHEMBL5798484

O=C1c2ccccc2C(=O)N1CC(O)CO

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.58
ALDH1A1 P00352 6/20 0.57
KMT2A Q03164 2/20 0.56
MAPT P10636 2/20 0.56
RAB9A P51151 2/20 0.55
CA12 O43570 1/20 0.48
CA9 Q16790 1/20 0.48
CASP3 P42574 2/20 0.44
GLS O94925 1/20 0.44
KDM4E B2RXH2 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL5798482 1.00 MAPK1 (0.58) MAPK1ALDH1A1KMT2AMAPTRAB9A
SCHEMBL6153732 1.00 MAPK1 (0.58) MAPK1ALDH1A1KMT2AMAPTRAB9A
SCHEMBL30268729 1.00 MAPK1 (0.58) MAPK1ALDH1A1KMT2AMAPTRAB9A
SCHEMBL8939993 0.90 ALDH1A1 (0.64) MAPK1ALDH1A1KMT2AMAPTRAB9A
SCHEMBL17595505 0.86 MAPK1 (0.59) MAPK1ALDH1A1KMT2AMAPTRAB9A
SCHEMBL4712246 0.85 MAPK1 (0.55) MAPK1ALDH1A1KMT2AMAPTRAB9A
SCHEMBL4633511 0.83 MAPK1 (0.56) MAPK1ALDH1A1KMT2AMAPTRAB9A
SCHEMBL5641347 0.83 MAPK1 (0.56) MAPK1ALDH1A1KMT2AMAPTRAB9A
SCHEMBL4633515 0.83 MAPK1 (0.56) MAPK1ALDH1A1KMT2AMAPTRAB9A
SCHEMBL6155955 0.83 ALDH1A1 (0.59) MAPK1ALDH1A1KMT2AMAPTRAB9A

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5663173-A CENTRAL NERVOUS SYSTEM DISORDERS, COGNITION ACTIVATORS, PYCHOSES, ANTIDEPRESSANTS AND EATING DISORDERS SYNTHELABO (FR) 1997-09-02 US claimed
EP-0748807-A1 Derivatives of N-(1,4-diazabicyclo(2.2.2)-oct-2-yl)methyl benzamide, their preparation and their therapeutical use SYNTHELABO (FR) 1996-12-18 EP claimed
CN-110770224-B Indole derivatives as efflux pump inhibitors 罗格斯新泽西州立大学 2022-11-18 CN disclosed
CN-110885325-B Preparation method of (S) -glycidol phthalimide 新发药业有限公司 2021-09-07 CN disclosed
WO-2020051967-A1 PREPARATION METHOD FOR (S)-GLYCIDYL PHTHALIMIDE 新发药业有限公司 2020-03-19 WO disclosed
CN-110885325-A Preparation method of (S) -glycidol phthalimide 新发药业有限公司 2020-03-17 CN disclosed
CN-110770224-A Indole derivatives as efflux pump inhibitors 罗格斯新泽西州立大学 2020-02-07 CN disclosed
CN-108586313-B Novel method for synthesizing N-substituted phthalic anhydride- (S) -isoserine 海正药业南通有限公司 2019-12-27 CN disclosed
CN-108586313-B Novel method for synthesizing N-substituted phthalic anhydride- (S) -isoserine 海正药业南通有限公司 2019-12-27 CN disclosed
EP-2986665-B1 NOVEL CYCLIC ACETAL, CYCLIC KETAL DIAMINES EPOXY CURING AGENTS AND DEGRADABLE POLYMERS AND COMPOSITES BASED THEREON ADESSO ADVANCED MAT WUHU CO LTD (CN) 2018-10-17 EP disclosed
US-10017602-B2 Cyclic acetal, cyclic ketal diamines epoxy curing agents and degradable polymers and composites based thereon ADESSO AVANCED MATERIALS WUHU CO., LTD. (CN) 2018-07-10 US disclosed
EP-2986665-A1 NOVEL CYCLIC ACETAL, CYCLIC KETAL DIAMINES EPOXY CURING AGENTS AND DEGRADABLE POLYMERS AND COMPOSITES BASED THEREON Adesso Advanced Materials Wuxi Co., Ltd. (CN) 2016-02-24 EP disclosed
US-20160046760-A1 NOVEL CYCLIC ACETAL, CYCLIC KETAL DIAMINES EPOXY CURING AGENTS AND DEGRADABLE POLYMERS AND COMPOSITES BASED THEREON ADESSO ADVANCED MATERIALS WUHU CO., LTD. (CN) 2016-02-18 US disclosed
WO-2014169846-A1 NOVEL CYCLIC ACETAL, CYCLIC KETAL DIAMINES EPOXY CURING AGENTS AND DEGRADABLE POLYMERS AND COMPOSITES BASED THEREON ADESSO ADVANCED MATERIALS WUXI CO., LTD. (CN) 2014-10-23 WO disclosed
WO-2006031179-A1 PROCESS FOR PREPARATION OF PHTALIMIDE ASTRAZENECA AB (SE) 2006-03-23 WO disclosed
US-20050215801-A1 Process for preparation of optically active 1-substituted amino-2,3-epoxypropanes, intermediates for synthesis thereof and process for preparation of the intermediates KANEKA CORPORATION (JP) 2005-09-29 US disclosed
EP-1553093-A1 PROCESS FOR PREPARATION OF OPTICALLY ACTIVE 1-SUBSTITUTED AMINO-2,3-EPOXYPROPANES, INTERMEDIATES FOR THE SYNTHESIS THEREOF AND PROCESS FOR PREPARATION OF THE INTERMEDIATES KANEKA CORPORATION (JP) 2005-07-13 EP disclosed
US-5663173-A CENTRAL NERVOUS SYSTEM DISORDERS, COGNITION ACTIVATORS, PYCHOSES, ANTIDEPRESSANTS AND EATING DISORDERS SYNTHELABO (FR) 1997-09-02 US disclosed
EP-0748807-A1 Derivatives of N-(1,4-diazabicyclo(2.2.2)-oct-2-yl)methyl benzamide, their preparation and their therapeutical use SYNTHELABO (FR) 1996-12-18 EP disclosed
WO-1996026939-A1 CARBAPENEM COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-09-06 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 (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-10017602-B2 Cyclic acetal, cyclic ketal diamines epoxy curing agents and degradable polymers and composites based thereon AOC1, JMJD6, KAT6A MAPK1 3507/4885ALDH1A1 243/4885KMT2A 306/4885
US-20160046760-A1 NOVEL CYCLIC ACETAL, CYCLIC KETAL DIAMINES EPOXY CURING AGENTS AND DEGRADABLE POLYMERS AND COMPOSITES BASED THEREON AOC1, JMJD6, THEM6 MAPK1 3598/4885ALDH1A1 275/4885KMT2A 327/4885
US-20050215801-A1 Process for preparation of optically active 1-substituted amino-2,3-epoxypropanes, intermediates for synthesis thereof and process for preparation of the intermediates OXER1, RCC2, CBR3 MAPK1 925/4885ALDH1A1 538/4885KMT2A 4293/4885

“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.