SCHEMBL2676329

SCHEMBL2676329

CCCCCCCCCCS[C@H](C(=O)O)[C@@H](SCCCCCCCCCC)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.55
MAPT P10636 2/20 0.50
HSD17B10 Q99714 2/20 0.50
GMNN O75496 1/20 0.50
TP53 P04637 1/20 0.50
POLB P06746 1/20 0.50
THRB P10828 1/20 0.50
CYP2C9 P11712 1/20 0.50
BLM P54132 1/20 0.50
GPR84 Q9NQS5 10/20 0.47
FFAR1 O14842 2/20 0.47
PPARD Q03181 7/20 0.45
CES2 O00748 1/20 0.45
LCK P06239 1/20 0.45
ZDHHC20 Q5W0Z9 1/20 0.45
ZDHHC2 Q9UIJ5 1/20 0.45
PPARG P37231 6/20 0.43
PPARA Q07869 6/20 0.43
HDAC11 Q96DB2 5/20 0.43
TSHR P16473 4/20 0.43

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
SCHEMBL11505923 0.88 EPHX1 (0.49) EPHX1MAPTHSD17B10GMNNTP53
Propionic Acid SCHEMBL7636098 0.85 EPHX1 (0.46) EPHX1MAPTHSD17B10GMNNTP53
SCHEMBL1644134 0.83 EPHX1 (0.52) EPHX1MAPTHSD17B10GMNNTP53
SCHEMBL18944802 0.83 EPHX1 (0.52) EPHX1MAPTHSD17B10GMNNTP53
SCHEMBL27395436 0.83 EPHX1 (0.52) EPHX1MAPTHSD17B10GMNNTP53
SCHEMBL5698801 0.83 EPHX1 (0.52) EPHX1MAPTHSD17B10GMNNTP53
SCHEMBL3421829 0.83 EPHX1 (0.52) EPHX1MAPTHSD17B10GMNNTP53
SCHEMBL3420845 0.83 EPHX1 (0.52) EPHX1MAPTHSD17B10GMNNTP53
SCHEMBL9099779 0.83 EPHX1 (0.52) EPHX1MAPTHSD17B10GMNNTP53
SCHEMBL9099579 0.83 EPHX1 (0.52) EPHX1MAPTHSD17B10GMNNTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9770442-B2 Self-assembling amphiphilic polymers as anti-cancer agents ALLEXCEL INC. (US) 2017-09-26 US disclosed
EP-2120974-B1 SELF-ASSEMBLING AMPHIPHILIC POLYMERS AS ANTIVIRAL AGENTS ALLEXCEL INC (US) 2017-03-01 EP disclosed
EP-2167103-B1 SELF-ASSEMBLING AMPHIPHILIC POLYMERS AS ANTICANCER AGENTS ALLEXCEL INC (US) 2017-03-01 EP disclosed
EP-1979407-B1 SOLUBILIZATION AND TARGETED DELIVERY OF DRUGS WITH SELF-ASSEMBLING AMPHIPHILIC POLYMERS ALLEXCEL INC (US) 2014-08-06 EP disclosed
US-8173764-B2 Solubilization and targeted delivery of drugs with self-assembling amphiphilic polymers ALLEXCEL INC. (US) 2012-05-08 US disclosed
US-20100260743-A1 Solubilization and Targeted Delivery of Drugs With Self-Assembling Amphiphilic Polymers ALLEXCEL, INC. (US) 2010-10-14 US disclosed
US-20100239659-A1 SELF-ASSEMBLING AMPHIPHILIC POLYMERS AS ANTI-CANCER AGENTS ALLEXCEL., INC. (US) 2010-09-23 US disclosed
US-20100008938-A1 SELF ASSEMBLING AMPHIPHILIC POLYMERS AS ANTIVIRAL AGENTS ALLEXCEL, INC. 2010-01-14 US disclosed
EP-1979407-A1 SOLUBILIZATION AND TARGETED DELIVERY OF DRUGS WITH SELF-ASSEMBLING AMPHIPHILIC POLYMERS Allexcel, Inc. (US) 2008-10-15 EP disclosed
WO-2007084126-A1 SOLUBILIZATION AND TARGETED DELIVERY OF DRUGS WITH SELF-ASSEMBLING AMPHIPHILIC POLYMERS ALLEXCEL, INC. (US) 2007-07-26 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 (3 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-20100008938-A1 SELF ASSEMBLING AMPHIPHILIC POLYMERS AS ANTIVIRAL AGENTS PICALM, CLTA, HAVCR2 EPHX1 3061/4885MAPT 326/4885HSD17B10 4194/4885
US-20100239659-A1 SELF-ASSEMBLING AMPHIPHILIC POLYMERS AS ANTI-CANCER AGENTS CD44, EPCAM, EGFR EPHX1 2622/4885MAPT 1351/4885HSD17B10 3661/4885
US-20100260743-A1 Solubilization and Targeted Delivery of Drugs With Self-Assembling Amphiphilic Polymers CD44, ABCG2, ABCC1 EPHX1 1339/4885MAPT 129/4885HSD17B10 2400/4885

“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.