SCHEMBL18057125

SCHEMBL18057125

CCCCCCCCCCCCCCCCOCC(CNC(=O)OCCOCCOC)OCCCCCCCCCCCCCCCC

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 17/20 0.57
LPAR1 Q92633 2/20 0.48
LPAR3 Q9UBY5 2/20 0.48

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
SCHEMBL25515284 1.00 TLR2 (0.57) TLR2LPAR1LPAR3
SCHEMBL18057124 1.00 TLR2 (0.57) TLR2LPAR1LPAR3
SCHEMBL10819300 1.00 TLR2 (0.57) TLR2LPAR1LPAR3
SCHEMBL11304197 1.00 TLR2 (0.57) TLR2LPAR1LPAR3
SCHEMBL15149390 0.92 TLR2 (0.53) TLR2LPAR1LPAR3
SCHEMBL102391 0.91 TLR2 (0.56) TLR2LPAR1LPAR3
SCHEMBL14950501 0.91 TLR2 (0.58) TLR2LPAR1LPAR3
SCHEMBL14924385 0.90 TLR2 (0.57) TLR2LPAR1LPAR3
SCHEMBL16475661 0.90 TLR2 (0.46) TLR2
SCHEMBL15071438 0.90 TLR2 (0.57) TLR2LPAR1LPAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180051285-A1 CATIONIC LIPID DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-02-22 US disclosed
US-9803199-B2 Cationic lipid DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-10-31 US disclosed
US-9803199-B2 Cationic lipid DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-10-31 US disclosed
US-20160257951-A1 NOVEL LIPID DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-09-08 US disclosed
US-20160257951-A1 NOVEL LIPID DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-09-08 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-20160257951-A1 NOVEL LIPID NPC1L1, CETP, LIPC TLR2 1446/4885LPAR1 56/4885LPAR3 77/4885
US-20180051285-A1 CATIONIC LIPID CETP, NPC1L1, LIPA TLR2 1013/4885LPAR1 45/4885LPAR3 55/4885

“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.