SCHEMBL2199451

SCHEMBL2199451

OCCCCC1CCCCO1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.45
LMNA P02545 3/20 0.37
POLB P06746 1/20 0.37
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HPGD P15428 3/20 0.36
TP53 P04637 1/20 0.36
ALOX12 P18054 1/20 0.36
KMT2A Q03164 3/20 0.35
HTT P42858 1/20 0.34
MEN1 O00255 2/20 0.33

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
SCHEMBL15108788 1.00 EPHX1 (0.45) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL19157470 1.00 EPHX1 (0.45) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL16790400 0.98 EPHX1 (0.48) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL7517942 0.98 EPHX1 (0.48) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL15241377 0.96 EPHX1 (0.47) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL12530810 0.96 EPHX1 (0.47) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL11178723 0.96 EPHX1 (0.47) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL18269644 0.94 EPHX1 (0.42) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL969836 0.94 EPHX1 (0.47) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL2198817 0.94 EPHX1 (0.42) EPHX1LMNAPOLBUSP2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2802561-B1 CHIRAL IMIDODIPHOSPHATES AND DERIVATIVES THEREOF STUDIENGESELLSCHAFT KOHLE MBH (DE) 2017-07-26 EP disclosed
US-20120283438-A1 COMPOUNDS GLAXOSMITHKLINE LLC (US) 2012-11-08 US disclosed
US-20110269781-A1 COMPOUNDS GLAXOSMITHKLINE LLC (US) 2011-11-03 US disclosed
US-7977344-B2 Compounds GLAXOSMITHKLINE LLC (US) 2011-07-12 US disclosed
EP-2125792-B1 PURINE DERIVATIVES AS IMMUNOMODULATORS GLAXOSMITHKLINE LLC (US) 2010-12-01 EP disclosed
US-20100120799-A1 PURINE DERIVATIVES AS IMMUNOMODULATORS SMITHKLINE BEECHAM CORPORATION (US) 2010-05-13 US disclosed
EP-2125792-A1 PURINE DERIVATIVES AS IMMUNOMODULATORS Smithkline Beecham Corporation (US) 2009-12-02 EP disclosed
US-20090131458-A1 Compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-05-21 US disclosed
CN-100439425-C Method for producing water-absorbent resin particles SUMITOMO SEIKA CHEMICALS (JP) 2008-12-03 CN disclosed
WO-2008101867-A1 PURINE DERIVATIVES AS IMMUNOMODULATORS SMITHKLINE BEECHAM CORPORATION (US) 2008-08-28 WO disclosed
CN-1761699-A Process for production of water-absorbing resin particles SUMITOMO SEIKA CHEMICALS (JP) 2006-04-19 CN 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 (4 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-20120283438-A1 COMPOUNDS LTC4S, LTB4R2, LTB4R EPHX1 372/4885LMNA 4732/4885POLB 2926/4885
US-20090131458-A1 Compounds LTC4S, LTB4R2, LTB4R EPHX1 372/4885LMNA 4732/4885POLB 2926/4885
US-20100120799-A1 PURINE DERIVATIVES AS IMMUNOMODULATORS LTC4S, STING1, LTB4R2 EPHX1 75/4885LMNA 2432/4885POLB 416/4885
US-20110269781-A1 COMPOUNDS LTC4S, LTB4R2, LTB4R EPHX1 372/4885LMNA 4732/4885POLB 2926/4885

“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.