SCHEMBL7202735

SCHEMBL7202735

CCCCCCCCC=CCCCCCCCCCCCCOC(CCCCCCCCCCCCC=CCCCCCCCC)C(O)CO

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.55
CNR1 P21554 1/20 0.55
CNR2 P34972 1/20 0.55
LPAR1 Q92633 1/20 0.43
LPAR2 Q9HBW0 1/20 0.43
LPAR3 Q9UBY5 1/20 0.43
DEGS1 O15121 1/20 0.43
DGKA P23743 1/20 0.43
MEN1 O00255 3/20 0.42
MAPT P10636 3/20 0.42
KMT2A Q03164 3/20 0.42
GMNN O75496 2/20 0.42
LMNA P02545 2/20 0.42
GLA P06280 2/20 0.42
POLB P06746 2/20 0.42
THRB P10828 2/20 0.42
CETP P11597 2/20 0.42
MAPK1 P28482 2/20 0.42
CXCR5 P32302 2/20 0.42
CCR6 P51684 2/20 0.42

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
SCHEMBL16086048 1.00 ALDH1A1 (0.55) ALDH1A1CNR1CNR2LPAR1LPAR2
SCHEMBL28992552 1.00 ALDH1A1 (0.55) ALDH1A1CNR1CNR2LPAR1LPAR2
SCHEMBL7591414 1.00 ALDH1A1 (0.55) ALDH1A1CNR1CNR2LPAR1LPAR2
SCHEMBL28992543 1.00 ALDH1A1 (0.55) ALDH1A1CNR1CNR2LPAR1LPAR2
SCHEMBL1735177 1.00 ALDH1A1 (0.55) ALDH1A1CNR1CNR2LPAR1LPAR2
Ethylene Glycol SCHEMBL26618285 0.98 ALDH1A1 (0.54) ALDH1A1CNR1CNR2LPAR1LPAR2
SCHEMBL16208869 0.96 ALDH1A1 (0.62) ALDH1A1CNR1CNR2
Ethylene Glycol SCHEMBL26618260 0.94 ALDH1A1 (0.61) ALDH1A1CNR1CNR2
SCHEMBL3892979 0.94 ALDH1A1 (0.64) ALDH1A1CNR1CNR2
SCHEMBL11459958 0.94 ALDH1A1 (0.55) ALDH1A1CNR1CNR2LPAR1LPAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030229037-A1 Novel cationic amphiphiles MASSING ULRICH (DE) 2003-12-11 US claimed
EP-1261620-A2 CATIONIC AMPHIPHILES FOR USE IN NUCLEIC ACID TRANSFECTION Roche Diagnostics Corporation (US) 2002-12-04 EP claimed
WO-2001057064-A2 CATIONIC AMPHIPHILES FOR USE IN NUCLEIC ACID TRANSFECTION ROCHE DIAGNOSTICS CORPORATION (US) 2001-08-09 WO claimed
EP-2976351-B1 LIPOHILLIC OLIGONUCLEOTIDE ANALOGS MILTENYI BIOTEC GMBH (DE) 2018-02-21 EP disclosed
US-9803198-B2 Lipohillic oligonucleotide analogs MILTENYI BIOTEC, GMBH (DE) 2017-10-31 US disclosed
EP-2976351-A1 LIPOHILLIC OLIGONUCLEOTIDE ANALOGS Miltenyi Biotec GmbH (DE) 2016-01-27 EP disclosed
US-20160017325-A1 LIPOHILLIC OLIGONUCLEOTIDE ANALOGS MILTENYI BIOTEC GMBH (DE) 2016-01-21 US disclosed
WO-2014147095-A1 LIPOHILLIC OLIGONUCLEOTIDE ANALOGS MILTENYI BIOTEC GMBH (DE) 2014-09-25 WO disclosed
EP-2781523-A1 Lipophilic oligonucleotide analogs Miltenyi Biotec GmbH (DE) 2014-09-24 EP disclosed
US-20030229037-A1 Novel cationic amphiphiles MASSING ULRICH (DE) 2003-12-11 US disclosed
EP-1261620-A2 CATIONIC AMPHIPHILES FOR USE IN NUCLEIC ACID TRANSFECTION Roche Diagnostics Corporation (US) 2002-12-04 EP disclosed
WO-2001057064-A2 CATIONIC AMPHIPHILES FOR USE IN NUCLEIC ACID TRANSFECTION ROCHE DIAGNOSTICS CORPORATION (US) 2001-08-09 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 (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-20030229037-A1 Novel cationic amphiphiles ABHD16A, APMAP, ABCB4 ALDH1A1 4355/4885CNR1 3587/4885CNR2 4074/4885

“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.