SCHEMBL148500

SCHEMBL148500

NCCOCCOC(C(=O)O)C(=O)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SLC1A1 P43005 3/20 0.42
SLC1A3 P43003 2/20 0.42
SLC1A2 P43004 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
ALDH1A1 P00352 4/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
IDO1 P14902 1/20 0.40
ITGB3 P05106 4/20 0.39
ITGA2B P08514 4/20 0.39

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
SCHEMBL6021991 0.80 ITGB3 (0.55) ALDH1A1ITGB3ITGA2B
SCHEMBL6440314 0.80 ITGB3 (0.55) ALDH1A1ITGB3ITGA2B
SCHEMBL148347 0.78 ALDH1A1 (0.43) SLC1A1SLC1A3SLC1A2KMT2AMEN1
SCHEMBL6443111 0.78 SLC7A5 (0.50) SLC1A1SLC1A3SLC1A2CYP1A2ITGB3
SCHEMBL17339044 0.77 KMT2A (0.45) KMT2A
SCHEMBL415413 0.77 KMT2A (0.45) KMT2A
SCHEMBL14762052 0.77 ALDH1A1 (0.53) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL17167174 0.77 ALDH1A1 (0.53) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL21814470 0.77 ALDH1A1 (0.53) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL20107370 0.77 ALDH1A1 (0.53) LMNASMN1; SMN2KMT2AALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060147411-A1 Novel compounds for the treatment of sickle cell disease UNIVERSITY OF MARYLAND, BALTIMORE (US) 2006-07-06 US claimed
US-7038078-B2 Methods of synthesizing and using derivatives of [2-(2-aminoethoxy)ethoxy] acetic acid UNIVERSITY OF MARLYLAND, BALTIMORE (US) 2006-05-02 US claimed
US-20030134989-A1 Methods of synthesizing and using derivatives of [2-(2-aminoethoxy)ethoxy] acetic acid NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-07-17 US claimed
WO-2002042259-A2 METHODS OF SYNTHESIZING AND USING DERIVATIVES OF [2-(2-AMINOETHOXY)ETHOXY] ACETIC ACID UNIVERSITY OF MARYLAND, BALTIMORE (US) 2002-05-30 WO claimed
US-20180015170-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY CERULEAN PHARMA INC (US) 2018-01-18 US disclosed
US-20160082111-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY CERULEAN PHARMA INC. (US) 2016-03-24 US disclosed
EP-2812008-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY Cerulean Pharma Inc. (US) 2014-12-17 EP disclosed
CN-104208716-A Cyclodextrin-based polymers for therapeutic delivery CERULEAN PHARMA INC 2014-12-17 CN disclosed
US-20140328918-A1 METHODS OF TREATING A SUBJECT AND RELATED PARTICLES, POLYMERS AND COMPOSITIONS CERULEAN PHARMA INC. (US) 2014-11-06 US disclosed
US-20140274947-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY CERULEAN PHARMA INC. (US) 2014-09-18 US disclosed
US-20130261173-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY CERULEAN PHARMA INC. (US) 2013-10-03 US disclosed
WO-2013115966-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY CERULEAN PHARMA INC. (US) 2013-08-08 WO disclosed
US-20110237540-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY CERULEAN PHARMA INC. 2011-09-29 US disclosed
WO-2011063421-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY CERULEAN PHARMA INC. (US) 2011-05-26 WO disclosed
US-20060147411-A1 Novel compounds for the treatment of sickle cell disease UNIVERSITY OF MARYLAND, BALTIMORE (US) 2006-07-06 US disclosed
US-7038078-B2 Methods of synthesizing and using derivatives of [2-(2-aminoethoxy)ethoxy] acetic acid UNIVERSITY OF MARLYLAND, BALTIMORE (US) 2006-05-02 US disclosed
US-20050187407-A1 Methods of synthesizing and using derivatives of [2-(2-aminoethoxy)ethoxy] acetic acid SUNBEAM PRODUCTS, INC. 2005-08-25 US disclosed
WO-2004069171-A2 NOVEL COMPOUNDS FOR THE TREATMENT OF SICKLE CELL DISEASE UNIVERSITY OF MARYLAND, BALTIMORE (US) 2004-08-19 WO disclosed
US-20030134989-A1 Methods of synthesizing and using derivatives of [2-(2-aminoethoxy)ethoxy] acetic acid NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-07-17 US disclosed
WO-2002042259-A2 METHODS OF SYNTHESIZING AND USING DERIVATIVES OF [2-(2-AMINOETHOXY)ETHOXY] ACETIC ACID UNIVERSITY OF MARYLAND, BALTIMORE (US) 2002-05-30 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 (9 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-20030134989-A1 Methods of synthesizing and using derivatives of [2-(2-aminoethoxy)ethoxy] acetic acid ELL, APEH, HACL2 LMNA 3102/4885SMN1; SMN2 4409/4885SLC1A1 1019/4885
US-20160082111-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY SDCBP, DDOST, DSC1 LMNA 2825/4885SMN1; SMN2 1075/4885SLC1A1 2637/4885
US-20140274947-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY SDCBP, DDOST, DSC1 LMNA 2825/4885SMN1; SMN2 1075/4885SLC1A1 2637/4885
US-20110237540-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY SDCBP, DDOST, DSC1 LMNA 2825/4885SMN1; SMN2 1075/4885SLC1A1 2637/4885
US-20060147411-A1 Novel compounds for the treatment of sickle cell disease HBB, MB, HBG1 LMNA 3907/4885SMN1; SMN2 397/4885SLC1A1 1375/4885
US-20050187407-A1 Methods of synthesizing and using derivatives of [2-(2-aminoethoxy)ethoxy] acetic acid ELL, APEH, HACL2 LMNA 2949/4885SMN1; SMN2 4393/4885SLC1A1 1134/4885
US-20140328918-A1 METHODS OF TREATING A SUBJECT AND RELATED PARTICLES, POLYMERS AND COMPOSITIONS HLA-DRB1, TSG101, IAPP LMNA 1261/4885SMN1; SMN2 1613/4885SLC1A1 4608/4885
US-20130261173-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY SDCBP, DDOST, DSC1 LMNA 2825/4885SMN1; SMN2 1075/4885SLC1A1 2637/4885
US-20180015170-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY SDCBP, DDOST, DSC1 LMNA 2825/4885SMN1; SMN2 1075/4885SLC1A1 2637/4885

“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.