SCHEMBL674128

SCHEMBL674128

CC(C)(C)OC(=O)C(CO)OCCN

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CPB1 P15086 2/20 0.34
CPB2 Q96IY4 2/20 0.34
NOS1 P29475 2/20 0.31
NOS3 P29474 1/20 0.31
NOS2 P35228 1/20 0.31

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
SCHEMBL29086267 0.86 CPB1 (0.32) CPB1CPB2NOS1NOS3NOS2
SCHEMBL5828857 0.81 TDP1 (0.32) CPB1CPB2
SCHEMBL29478490 0.81 ALDH1A1 (0.38)
SCHEMBL20569401 0.79 TDP1 (0.32) NOS1NOS3NOS2
SCHEMBL1937378 0.78 APLNR (0.30)
SCHEMBL30874619 0.78 NOS1 (0.35) NOS1NOS3NOS2
SCHEMBL30831230 0.77 NOS1 (0.30) NOS1NOS3NOS2
SCHEMBL9108794 0.75 PRKCA (0.33) NOS1NOS3NOS2
SCHEMBL12527313 0.73 TDP1 (0.33)
SCHEMBL5828855 0.71 CTH (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11612662-B2 Multi-arm polymeric prodrug conjugates of pemetrexed-based compounds NEKTAR THERAPEUTICS (US) 2023-03-28 US disclosed
US-20200323992-A1 MULTI-ARM POLYMERIC PRODRUG CONJUGATES OF PEMETREXED-BASED COMPOUNDS NEKTAR THERAPEUTICS (US) 2020-10-15 US disclosed
US-10736969-B2 Multi-arm polymeric prodrug conjugates of pemetrexed-based compounds NEKTAR THERAPEUTICS (US) 2020-08-11 US disclosed
EP-2654795-B1 MULTI-ARM POLYMERIC PRODRUG CONJUGATES OF PEMETREXED-BASED COMPOUNDS NEKTAR THERAPEUTICS (US) 2018-03-07 EP disclosed
US-20150209440-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS OF USE CERULEAN PHARMA INC. (US) 2015-07-30 US disclosed
WO-2015057847-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS CERULEAN PHARMA INC. (US) 2015-04-23 WO disclosed
EP-2817345-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS Cerulean Pharma Inc. (US) 2014-12-31 EP disclosed
US-20140296322-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS OF USE CERULEAN PHARMA INC. (US) 2014-10-02 US disclosed
US-20140037573-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS CERULEAN PHARMA INC (US) 2014-02-06 US disclosed
US-20130338175-A1 Multi-Arm Polymeric Prodrug Conjugates of Pemetrexed-Based Compounds NEKTAR THERAPEUTICS (US) 2013-12-19 US disclosed
EP-2654795-A1 MULTI-ARM POLYMERIC PRODRUG CONJUGATES OF PEMETREXED-BASED COMPOUNDS Nektar Therapeutics (US) 2013-10-30 EP disclosed
WO-2013126564-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS CERULEAN PHARMA INC. (US) 2013-08-29 WO disclosed
EP-2605799-A2 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS Cerulean Pharma Inc. (US) 2013-06-26 EP disclosed
US-20120302622-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS CERULEAN PHARMA INC. (US) 2012-11-29 US disclosed
US-20120225129-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS CERULEAN PHARMA INC. (US) 2012-09-06 US disclosed
WO-2012088282-A1 MULTI-ARM POLYMERIC PRODRUG CONJUGATES OF PEMETREXED-BASED COMPOUNDS NEKTAR THERAPEUTICS (US) 2012-06-28 WO disclosed
WO-2012024526-A2 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS CERULEAN PHARMA INC. (US) 2012-02-23 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-20140296322-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS OF USE CD44, DIS3, POLN CPB1 1232/4885CPB2 1577/4885NOS1 4685/4885
US-11612662-B2 Multi-arm polymeric prodrug conjugates of pemetrexed-based compounds PAICS, MTHFD2, MTHFD1 CPB1 1914/4885CPB2 2438/4885NOS1 4766/4885
US-20140037573-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS SYNCRIP, EXOSC5, EXOSC9 CPB1 1427/4885CPB2 1902/4885NOS1 4678/4885
US-20120302622-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS SYNCRIP, EXOSC5, EXOSC9 CPB1 1427/4885CPB2 1902/4885NOS1 4678/4885
US-10736969-B2 Multi-arm polymeric prodrug conjugates of pemetrexed-based compounds PAICS, MTHFD2, MTHFD1 CPB1 1914/4885CPB2 2438/4885NOS1 4766/4885
US-20200323992-A1 MULTI-ARM POLYMERIC PRODRUG CONJUGATES OF PEMETREXED-BASED COMPOUNDS PAICS, MTHFD2, MTHFD1 CPB1 1914/4885CPB2 2438/4885NOS1 4766/4885
US-20130338175-A1 Multi-Arm Polymeric Prodrug Conjugates of Pemetrexed-Based Compounds PAICS, PARP6, PARP1 CPB1 2349/4885CPB2 2816/4885NOS1 4839/4885
US-20150209440-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS OF USE CD44, DIS3, POLN CPB1 1232/4885CPB2 1577/4885NOS1 4685/4885
US-20120225129-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS SYNCRIP, EXOSC5, EXOSC9 CPB1 1427/4885CPB2 1902/4885NOS1 4678/4885

“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.