SCHEMBL11961102

SCHEMBL11961102

CCCCC/C=C\C/C=C\CCCCCCCCOCC(COS(C)(=O)=S)OCCCCCCCC/C=C\C/C=C\CCCCC

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.52
▸ CNR1 P21554 1/20 0.52
▸ CNR2 P34972 1/20 0.52
▸ LPAR1 Q92633 4/20 0.45
▸ LPAR3 Q9UBY5 4/20 0.45
▸ LPAR2 Q9HBW0 1/20 0.44

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
SCHEMBL1077368 0.90 ALDH1A1 (0.55) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL26366389 0.86 LPAR1 (0.49) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL1395273 0.85 ALDH1A1 (0.69) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL5461723 0.84 ALDH1A1 (0.67) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL21326401 0.82 ALDH1A1 (0.63) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL26566666 0.82 ALDH1A1 (0.63) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL11961104 0.81 ALDH1A1 (0.53) ALDH1A1CNR1CNR2
SCHEMBL9718660 0.81 ALDH1A1 (0.60) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL9718817 0.81 ALDH1A1 (0.60) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL4094364 0.81 ALDH1A1 (0.60) ALDH1A1CNR1CNR2LPAR1LPAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8569256-B2 Cationic lipids and methods for the delivery of therapeutic agents PROTIVA BIOTHERAPEUTICS, INC. (CA) 2013-10-29 — — US disclosed
US-20120202871-A1 CATIONIC LIPIDS AND METHODS FOR THE DELIVERY OF THERAPEUTIC AGENTS PROTIVA BIOTHERAPEUTICS, INC. 2012-08-09 — — US disclosed
US-20120202871-A1 CATIONIC LIPIDS AND METHODS FOR THE DELIVERY OF THERAPEUTIC AGENTS PROTIVA BIOTHERAPEUTICS, INC. 2012-08-09 — — US disclosed
WO-2011000106-A1 IMPROVED CATIONIC LIPIDS AND METHODS FOR THE DELIVERY OF THERAPEUTIC AGENTS PROTIVA BIOTHERAPEUTICS, INC. (CA) 2011-01-06 — — 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-20120202871-A1 CATIONIC LIPIDS AND METHODS FOR THE DELIVERY OF THERAPEUTIC AGENTS LDLR, NPC1, CETP ALDH1A1 4573/4885CNR1 3953/4885CNR2 4115/4885

“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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