SCHEMBL2233806

SCHEMBL2233806

CCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OCCCCC(=O)OC(c1ccccc1)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 1/20 0.69
▸ ALDH1A1 P00352 2/20 0.61
▸ SMN1; SMN2 Q16637 2/20 0.60
▸ NR5A2 O00482 1/20 0.60
▸ NR5A1 Q13285 1/20 0.60
▸ ADRA1D P25100 1/20 0.59
▸ PTAFR P25105 1/20 0.59
▸ HTR1D P28221 1/20 0.59
▸ HTR2C P28335 1/20 0.59
▸ ADRA1B P35368 1/20 0.59
▸ DRD3 P35462 1/20 0.59
▸ TMEM97 Q5BJF2 1/20 0.59
▸ PRKD3 O94806 1/20 0.56
▸ PRKCG P05129 1/20 0.56
▸ PRKCB P05771 1/20 0.56
▸ PRKCA P17252 1/20 0.56
▸ PRKCH P24723 1/20 0.56
▸ AKT1 P31749 1/20 0.56
▸ PRKCI P41743 1/20 0.56
▸ PRKCE Q02156 1/20 0.56

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
SCHEMBL1966041 0.87 RECQL (0.55) RECQLALDH1A1SMN1; SMN2NR5A2NR5A1
SCHEMBL20143294 0.84 RECQL (0.72) RECQLALDH1A1SMN1; SMN2NR5A2NR5A1
SCHEMBL2231964 0.84 RECQL (0.72) RECQLALDH1A1SMN1; SMN2NR5A2NR5A1
SCHEMBL2230910 0.84 RECQL (0.72) RECQLALDH1A1SMN1; SMN2NR5A2NR5A1
SCHEMBL2231689 0.84 RECQL (0.72) RECQLALDH1A1SMN1; SMN2NR5A2NR5A1
SCHEMBL704034 0.84 RECQL (0.81) RECQLALDH1A1SMN1; SMN2NR5A2NR5A1
Vb-201 SCHEMBL2071230 0.84 RECQL (0.81) RECQLALDH1A1SMN1; SMN2NR5A2NR5A1
Vb-201 SCHEMBL2071110 0.84 RECQL (0.81) RECQLALDH1A1SMN1; SMN2NR5A2NR5A1
Vb-201 SCHEMBL14322398 0.84 RECQL (0.81) RECQLALDH1A1SMN1; SMN2NR5A2NR5A1
SCHEMBL20143296 0.84 RECQL (0.81) RECQLALDH1A1SMN1; SMN2NR5A2NR5A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9206206-B2 Oxidized lipid compounds and uses thereof VASCULAR BIOGENICS LTD. (IL) 2015-12-08 — — US disclosed
EP-2826370-A2 Oxidized lipid compounds and uses thereof Vascular Biogenics Ltd. (IL) 2015-01-21 — — EP disclosed
EP-2826369-A2 Oxidized lipid compounds and uses thereof Vascular Biogenics Ltd. (IL) 2015-01-21 — — EP disclosed
EP-2348866-B1 OXIDIZED LIPID COMPOUNDS AND USES THEREOF VASCULAR BIOGENICS LTD (IL) 2015-01-07 — — EP disclosed
US-20130203707-A1 Oxidized Lipid Compounds and Uses Thereof VASCULAR BIOGENICS LTD. (IL) 2013-08-08 — — US disclosed
US-20110207703-A1 OXIDIZED LIPID COMPOUNDS AND USES THEREOF VASCULAR BIOGENICS LTD. (IL) 2011-08-25 — — US 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-20130203707-A1 Oxidized Lipid Compounds and Uses Thereof LPO, GPX4, ALOX15B RECQL 4132/4885ALDH1A1 616/4885SMN1; SMN2 4440/4885
US-20110207703-A1 OXIDIZED LIPID COMPOUNDS AND USES THEREOF LPO, GPX4, ALOX15B RECQL 4132/4885ALDH1A1 616/4885SMN1; SMN2 4440/4885

“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.

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