SCHEMBL2411902

SCHEMBL2411902

CCCCCCCCCCCCOC[C@H](COCc1ccccc1)OCCCCCCCCCCCC

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 2/20 0.55
PLA2G2A P14555 2/20 0.55
TLR2 O60603 8/20 0.49
LPAR1 Q92633 4/20 0.49
LPAR3 Q9UBY5 4/20 0.49
LPAR2 Q9HBW0 1/20 0.49
PLA2G1B P04054 1/20 0.48
PLA2G5 P39877 1/20 0.48
CETP P11597 3/20 0.46

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
SCHEMBL3762356 1.00 PLA2G10 (0.55) PLA2G10PLA2G2ATLR2LPAR1LPAR3
SCHEMBL31514669 1.00 PLA2G10 (0.55) PLA2G10PLA2G2ATLR2LPAR1LPAR3
SCHEMBL6811774 1.00 PLA2G10 (0.55) PLA2G10PLA2G2ATLR2LPAR1LPAR3
SCHEMBL25078776 1.00 PLA2G10 (0.55) PLA2G10PLA2G2ATLR2LPAR1LPAR3
SCHEMBL13997509 1.00 PLA2G10 (0.55) PLA2G10PLA2G2ATLR2LPAR1LPAR3
SCHEMBL25078765 1.00 PLA2G10 (0.55) PLA2G10PLA2G2ATLR2LPAR1LPAR3
SCHEMBL6813208 1.00 PLA2G10 (0.55) PLA2G10PLA2G2ATLR2LPAR1LPAR3
SCHEMBL4368865 1.00 PLA2G10 (0.55) PLA2G10PLA2G2ATLR2LPAR1LPAR3
SCHEMBL2411920 1.00 PLA2G10 (0.55) PLA2G10PLA2G2ATLR2LPAR1LPAR3
SCHEMBL31514666 1.00 PLA2G10 (0.55) PLA2G10PLA2G2ATLR2LPAR1LPAR3

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-9365506-B2 Compounds and compositions as TLR2 agonists NOVARTIS AG (CH) 2016-06-14 US disclosed
US-20140323390-A1 COMPOUNDS AND COMPOSITIONS AS TLR2 AGONISTS IRM LLC (BM) 2014-10-30 US disclosed
US-8808703-B2 Compounds (cystein based lipopeptides) and compositions as TLR2 agonists used for treating infections, inflammations, respiratory diseases etc NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2014-08-19 US disclosed
US-20130065861-A1 COMPOUNDS (CYSTEIN BASED LIPOPEPTIDES) AND COMPOSITIONS AS TLR2 AGONISTS USED FOR TREATING INFECTIONS, INFLAMMATIONS, RESPIRATORY DISEASES ETC. IRM LLC (BM) 2013-03-14 US disclosed
EP-2549990-A1 COMPOUNDS (CYSTEIN BASED LIPOPEPTIDES) AND COMPOSITIONS AS TLR2 AGONISTS USED FOR TREATING INFECTIONS, INFLAMMATIONS, RESPIRATORY DISEASES ETC. IRM LLC (BM) 2013-01-30 EP disclosed
WO-2011119759-A1 COMPOUNDS (CYSTEIN BASED LIPOPEPTIDES) AND COMPOSITIONS AS TLR2 AGONISTS USED FOR TREATING INFECTIONS, INFLAMMATIONS, RESPIRATORY DISEASES ETC. IRM LLC (BM) 2011-09-29 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 (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-20140323390-A1 COMPOUNDS AND COMPOSITIONS AS TLR2 AGONISTS TLR2, TLR1, TLR3 PLA2G10 302/4885PLA2G2A 211/4885TLR2 1/4885
US-20130065861-A1 COMPOUNDS (CYSTEIN BASED LIPOPEPTIDES) AND COMPOSITIONS AS TLR2 AGONISTS USED FOR TREATING INFECTIONS, INFLAMMATIONS, RESPIRATORY DISEASES ETC. TLR2, TLR4, TLR3 PLA2G10 377/4885PLA2G2A 393/4885TLR2 1/4885

“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.