SCHEMBL652994

SCHEMBL652994

O=C(OC[C@H]1O[C@](O)(Br)[C@@H](OC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.52
POLB P06746 2/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
USP2 O75604 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPK1 P28482 2/20 0.42
GAA P10253 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
PTPN1 P18031 4/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
GAPDH P04406 1/20 0.39
LGALS9 O00182 1/20 0.39
LGALS1 P09382 1/20 0.39
LGALS3 P17931 1/20 0.39
LGALS7; LGALS7B P47929 1/20 0.39
PTPN2 P17706 1/20 0.38
PTPN11 Q06124 1/20 0.38

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
SCHEMBL5139788 1.00 MAPT (0.52) MAPTPOLBKMT2AMEN1USP2
SCHEMBL4960765 1.00 MAPT (0.52) MAPTPOLBKMT2AMEN1USP2
SCHEMBL4962623 1.00 MAPT (0.52) MAPTPOLBKMT2AMEN1USP2
SCHEMBL8512702 0.96 MAPT (0.55) MAPTPOLBKMT2AMEN1USP2
SCHEMBL9137960 0.96 MAPT (0.55) MAPTPOLBKMT2AMEN1USP2
SCHEMBL8512700 0.96 MAPT (0.55) MAPTPOLBKMT2AMEN1USP2
SCHEMBL11073044 0.96 MAPT (0.55) MAPTPOLBKMT2AMEN1USP2
SCHEMBL3060466 0.90 MAPT (0.47) MAPTPOLBKMT2AMEN1USP2
SCHEMBL8892883 0.86 NT5E (0.46) MAPTPOLBKMT2AMEN1USP2
SCHEMBL8892887 0.86 NT5E (0.46) MAPTPOLBKMT2AMEN1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2391218-B1 CONJUGATE BASED SYSTEMS FOR CONTROLLED DRUG DELIVERY SMARTCELLS INC (US) 2020-03-18 EP disclosed
US-10398781-B2 Conjugate based systems for controlled drug delivery SMARTCELLS, INC. (US) 2019-09-03 US disclosed
US-20180064824-A1 CONJUGATE BASED SYSTEMS FOR CONTROLLED DRUG DELIVERY MERCK SHARP & DOHME CORP. (US) 2018-03-08 US disclosed
US-9745355-B2 Binding-site modified lectins and uses thereof SMARTCELLS, INC. (US) 2017-08-29 US disclosed
US-9579391-B2 Conjugate based systems for controlled drug delivery SMARTCELLS, INC. (US) 2017-02-28 US disclosed
US-20170022262-A1 CRYSTALLINE INSULIN-CONJUGATES SMARTCELLS, INC. (US) 2017-01-26 US disclosed
US-9463249-B2 Crystalline insulin-conjugates SMARTCELLS, INC. (US) 2016-10-11 US disclosed
EP-2391646-B1 CRYSTALLINE INSULIN-CONJUGATES SMARTCELLS INC (US) 2016-08-10 EP disclosed
US-20160193351-A1 CONJUGATE BASED SYSTEMS FOR CONTROLLED DRUG DELIVERY SMARTCELLS, INC. (US) 2016-07-07 US disclosed
US-9265838-B2 Conjugate based systems for controlled drug delivery SMART CELLS, INC. (US) 2016-02-23 US disclosed
US-20130324702-A1 RECOMBINANT LECTINS, BINDING-SITE MODIFIED LECTINS AND USES THEREOF SMARTCELLS, INC. 2013-12-05 US disclosed
US-8569231-B2 Soluble non-depot insulin conjugates and uses thereof SMARTCELLS, INC. (US) 2013-10-29 US disclosed
US-20130190475-A1 DRUG-LIGAND CONJUGATES, SYNTHESIS THEREOF, AND INTERMEDIATES THERETO SMARTCELLS, INC. (US) 2013-07-25 US disclosed
US-20130131310-A1 DRUG-LIGAND CONJUGATES, SYNTHESIS THEREOF, AND INTERMEDIATES THERETO SMARTCELLS, INC. 2013-05-23 US disclosed
US-20120046223-A1 EXOGENOUSLY TRIGGERED CONTROLLED RELEASE MATERIALS AND USES THEREOF SMARTCELLS, INC. 2012-02-23 US disclosed
US-20120010134-A1 SOLUBLE NON-DEPOT INSULIN CONJUGATES AND USES THEREOF SMARTCELLS, INC. 2012-01-12 US disclosed
US-20110301083-A1 CONJUGATE BASED SYSTEMS FOR CONTROLLED DRUG DELIVERY SMARTCELLS, INC. 2011-12-08 US disclosed
US-20110281792-A1 BINDING-SITE MODIFIED LECTINS AND USES THEREOF SMARTCELLS, INC. 2011-11-17 US disclosed
US-20110281791-A1 CRYSTALLINE INSULIN-CONJUGATES SMARTCELLS, INC. 2011-11-17 US disclosed
US-20110275560-A1 SYNTHETIC CONJUGATES AND USES THEREOF SMARTCELLS, INC. 2011-11-10 US 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 (13 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-20110275560-A1 SYNTHETIC CONJUGATES AND USES THEREOF SLC2A4, SLC2A8, CD44 MAPT 3495/4885POLB 4617/4885KMT2A 1875/4885
US-10398781-B2 Conjugate based systems for controlled drug delivery SI, CSGALNACT1, CD44 MAPT 2050/4885POLB 4845/4885KMT2A 3261/4885
US-20130190475-A1 DRUG-LIGAND CONJUGATES, SYNTHESIS THEREOF, AND INTERMEDIATES THERETO ALK, ACVR1, ACVRL1 MAPT 2550/4885POLB 4457/4885KMT2A 994/4885
US-20120010134-A1 SOLUBLE NON-DEPOT INSULIN CONJUGATES AND USES THEREOF GPR119, IAPP, IRS1 MAPT 3646/4885POLB 4856/4885KMT2A 1976/4885
US-20110301083-A1 CONJUGATE BASED SYSTEMS FOR CONTROLLED DRUG DELIVERY SI, CSGALNACT1, CD44 MAPT 2050/4885POLB 4845/4885KMT2A 3261/4885
US-20110281791-A1 CRYSTALLINE INSULIN-CONJUGATES IAPP, INSR, GPR119 MAPT 363/4885POLB 4049/4885KMT2A 4507/4885
US-20110281792-A1 BINDING-SITE MODIFIED LECTINS AND USES THEREOF SIGLEC7, SIGLEC9, LGALS3BP MAPT 4266/4885POLB 4846/4885KMT2A 3096/4885
US-20180064824-A1 CONJUGATE BASED SYSTEMS FOR CONTROLLED DRUG DELIVERY SI, CSGALNACT1, CD44 MAPT 2050/4885POLB 4845/4885KMT2A 3261/4885
US-20130131310-A1 DRUG-LIGAND CONJUGATES, SYNTHESIS THEREOF, AND INTERMEDIATES THERETO ALK, ABL1, ERBB3 MAPT 1797/4885POLB 4441/4885KMT2A 1816/4885
US-20170022262-A1 CRYSTALLINE INSULIN-CONJUGATES IAPP, INSR, GPR119 MAPT 363/4885POLB 4049/4885KMT2A 4507/4885
US-20130324702-A1 RECOMBINANT LECTINS, BINDING-SITE MODIFIED LECTINS AND USES THEREOF MASP2, LGALS3BP, SIGLEC7 MAPT 4352/4885POLB 4858/4885KMT2A 3541/4885
US-20160193351-A1 CONJUGATE BASED SYSTEMS FOR CONTROLLED DRUG DELIVERY SI, CSGALNACT1, CD44 MAPT 2050/4885POLB 4845/4885KMT2A 3261/4885
US-20120046223-A1 EXOGENOUSLY TRIGGERED CONTROLLED RELEASE MATERIALS AND USES THEREOF CD63, NSF, MSN MAPT 3265/4885POLB 4805/4885KMT2A 3348/4885

“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.