SCHEMBL1265010

SCHEMBL1265010

CCOC(=O)CCCCCCCCCCCCCCCCO

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.59
DGKA P23743 1/20 0.54
ALDH1A1 P00352 2/20 0.53
ALOX15 P16050 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
CYP3A4 P08684 1/20 0.53
TSHR P16473 1/20 0.53
HSD17B10 Q99714 1/20 0.53
GAA P10253 2/20 0.52
CYP4F2 P78329 3/20 0.50
CYP4A11 Q02928 3/20 0.50
PAM P19021 2/20 0.48
KDM4E B2RXH2 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MGAM O43451 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
USP2 O75604 1/20 0.47
KMT2A Q03164 2/20 0.47
DUSP3 P51452 1/20 0.47

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
SCHEMBL3503495 1.00 CYP1A2 (0.59) CYP1A2DGKAALDH1A1ALOX15TDP1
SCHEMBL3288792 1.00 CYP1A2 (0.59) CYP1A2DGKAALDH1A1ALOX15TDP1
SCHEMBL3501621 1.00 CYP1A2 (0.59) CYP1A2DGKAALDH1A1ALOX15TDP1
SCHEMBL247007 1.00 CYP1A2 (0.59) CYP1A2DGKAALDH1A1ALOX15TDP1
SCHEMBL1896403 1.00 CYP1A2 (0.59) CYP1A2DGKAALDH1A1ALOX15TDP1
SCHEMBL3503524 1.00 CYP1A2 (0.59) CYP1A2DGKAALDH1A1ALOX15TDP1
SCHEMBL3503187 1.00 CYP1A2 (0.59) CYP1A2DGKAALDH1A1ALOX15TDP1
SCHEMBL2559740 1.00 CYP1A2 (0.59) CYP1A2DGKAALDH1A1ALOX15TDP1
SCHEMBL1060504 1.00 CYP1A2 (0.59) CYP1A2DGKAALDH1A1ALOX15TDP1
SCHEMBL1065093 1.00 CYP1A2 (0.59) CYP1A2DGKAALDH1A1ALOX15TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150191607-A1 Anti-fouling Paints and Coatings REACTIVE SURFACES, LTD (US) 2015-07-09 US disclosed
US-7893286-B2 Method for the synthesis of phospholipid ethers CELLECTAR, INC. (US) 2011-02-22 US disclosed
US-7893286-B2 Method for the synthesis of phospholipid ethers CELLECTAR, INC. (US) 2011-02-22 US disclosed
US-20100210745-A1 Molecular Healing of Polymeric Materials, Coatings, Plastics, Elastomers, Composites, Laminates, Adhesives, and Sealants by Active Enzymes REACTIVE SURFACES, LTD. (US) 2010-08-19 US disclosed
US-20080312459-A1 Method for the synthesis of phospholipid ethers CELL ACQUISITION CORP. 2008-12-18 US disclosed
US-20080312459-A1 Method for the synthesis of phospholipid ethers CELL ACQUISITION CORP. 2008-12-18 US disclosed
EP-0885886-B1 PYRIDINECARBOXAMIDE DERIVATIVES NISSHIN SEIFUN GROUP INC (JP) 2002-05-29 EP disclosed
US-5972943-A N-(NITRIC ACID,C14-18 ALKYL ESTER)-6-(1-(OPTIONALLY 4-SUBSTITUTED PIPERAZINYL)) PYRIDINE-3-CARBOXAMIDES; METHOD OF SYNTHESIS; ADMINISTERING TO TREAT CEREBRAL EDEMA; NO HYPOTENSIVE SIDE EFFECT NISSHIN FLOUR MILLING CO., LTD. (JP) 1999-10-26 US disclosed
EP-0885886-A1 NOVEL PYRIDINECARBOXAMIDE DERIVATIVES Nisshin Flour Milling Co., Ltd. (JP) 1998-12-23 EP 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 (1 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-20080312459-A1 Method for the synthesis of phospholipid ethers PHOSPHO1, PLEC, PLA2G2C CYP1A2 2338/4885DGKA 207/4885ALDH1A1 3190/4885

“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.