SCHEMBL4331049

SCHEMBL4331049

CCCCCCCCCCCCCC(=O)OCC(C)(C)C

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.64
PAM P19021 2/20 0.58
MAPT P10636 2/20 0.55
TSHR P16473 1/20 0.55
LMNA P02545 4/20 0.53
DNM1 Q05193 1/20 0.53
ALDH1A1 P00352 1/20 0.53
KDM4E B2RXH2 1/20 0.51
DUSP3 P51452 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
PRKCA P17252 1/20 0.49
PRKCE Q02156 1/20 0.49
PRKCQ Q04759 1/20 0.49
PRKCD Q05655 1/20 0.49
MAPK1 P28482 1/20 0.47
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46

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
SCHEMBL8084720 1.00 DGKA (0.64) DGKAPAMMAPTTSHRLMNA
SCHEMBL6536458 1.00 DGKA (0.64) DGKAPAMMAPTTSHRLMNA
SCHEMBL3161151 1.00 DGKA (0.64) DGKAPAMMAPTTSHRLMNA
SCHEMBL4624636 1.00 DGKA (0.64) DGKAPAMMAPTTSHRLMNA
SCHEMBL13073330 1.00 DGKA (0.64) DGKAPAMMAPTTSHRLMNA
SCHEMBL5709908 1.00 DGKA (0.64) DGKAPAMMAPTTSHRLMNA
Ammonia Solution, Strong SCHEMBL6749467 0.98 DGKA (0.62) DGKAPAMMAPTTSHRLMNA
SCHEMBL245738 0.98 DGKA (0.61) DGKAPAMMAPTTSHRLMNA
Ethylene Glycol SCHEMBL9815228 0.94 DGKA (0.58) DGKAPAMMAPTTSHRLMNA
Ethylene Glycol SCHEMBL9390653 0.94 DGKA (0.58) DGKAPAMMAPTTSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090239790-A1 NOVEL RECOMBINANT PROTEINS WITH N-TERMINAL FREE THIOL POOL CHADLER 2009-09-24 US disclosed
EP-1641481-A4 FORMATION OF NOVEL ERYTHROPOIETIN CONJUGATES USING TRANSGLUTAMINASE CENTOCOR INC (US) 2008-10-15 EP disclosed
EP-1699920-A4 NOVEL RECOMBINANT PROTEINS WITH N-TERMINAL FREE THIOL CENTOCOR INC (US) 2008-05-28 EP disclosed
EP-1699920-A2 NOVEL RECOMBINANT PROTEINS WITH N-TERMINAL FREE THIOL CENTOCOR, INC. (US) 2006-09-13 EP disclosed
US-7074755-B2 Erythropoietin conjugate compounds with extended half-lives CENTOCOR, INC. (US) 2006-07-11 US disclosed
US-20060116322-A1 Formation of novel erythropoietin conjugates using transglutaminase CENTOCOR, INC. 2006-06-01 US disclosed
EP-1641481-A2 FORMATION OF NOVEL ERYTHROPOIETIN CONJUGATES USING TRANSGLUTAMINASE CENTOCOR, INC. (US) 2006-04-05 EP disclosed
US-6995245-B2 Formation of novel erythropoietin conjugates using transglutaminase CENTOCOR, INC. (US) 2006-02-07 US disclosed
EP-1144452-B1 MODIFIED ANTIBODIES AND ANTIBODY FRAGMENTS WITH INCREASED DURATION OF ACTIVITY CENTOCOR INC (US) 2006-01-11 EP disclosed
US-20050170457-A1 Novel recombinant proteins with N-terminal free thiol CENTOCOR, INC. 2005-08-04 US disclosed
WO-2005065239-A2 NOVEL RECOMBINANT PROTEINS WITH N-TERMINAL FREE THIOL CENTOCOR, INC. (US) 2005-07-21 WO disclosed
US-20040266690-A1 Formation of novel erythropoietin conjugates using transglutaminase CENTOCOR INC. 2004-12-30 US disclosed
WO-2004108667-A2 FORMATION OF NOVEL ERYTHROPOIETIN CONJUGATES USING TRANSGLUTAMINASE CENTOCOR, INC. (US) 2004-12-16 WO disclosed
WO-2004106373-A1 ERYTHROPOIETIN CONJUGATE COMPOUNDS WITH EXTENDED HALF-LIVES CENTOCOR, INC. (US) 2004-12-09 WO disclosed
US-20040229318-A1 Erythropoietin conjugate compounds with extended half-lives CENTOCOR, INC. 2004-11-18 US disclosed
WO-2000026256-A9 MODIFIED ANTIBODIES AND ANTIBODY FRAGMENTS WITH INCREASED DURATION OF ACTIVITY CENTOCOR INC (US) 2002-08-22 WO disclosed
EP-1144452-A3 MODIFIED ANTIBODIES AND ANTIBODY FRAGMENTS WITH INCREASED DURATION OF ACTIVITY CENTOCOR, INC. (US) 2002-03-13 EP disclosed
EP-1144452-A2 MODIFIED ANTIBODIES AND ANTIBODY FRAGMENTS WITH INCREASED DURATION OF ACTIVITY CENTOCOR, INC. (US) 2001-10-17 EP disclosed
WO-2000026256-A2 MODIFIED ANTIBODIES AND ANTIBODY FRAGMENTS WITH INCREASED DURATION OF ACTIVITY CENTOCOR, INC. (US) 2000-05-11 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 (2 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-20040266690-A1 Formation of novel erythropoietin conjugates using transglutaminase EPOR, HBG2, TGM3 DGKA 2634/4885PAM 127/4885MAPT 2868/4885
US-20060116322-A1 Formation of novel erythropoietin conjugates using transglutaminase EPOR, HBG2, TGM3 DGKA 2634/4885PAM 127/4885MAPT 2868/4885

“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.