SCHEMBL16509347

SCHEMBL16509347

CCCCCCCC/C=C\CCCCCCCC(=O)NC1C(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(O)C(C)C4O)C(C)C3O)C(C)C2O)OC(CO)C(O)C1O

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TLR4 O00206 10/20 0.53
▸ MAPK1 P28482 1/20 0.45
▸ SELP P16109 4/20 0.45
▸ LY96 Q9Y6Y9 6/20 0.43
▸ GJB2 P29033 1/20 0.42
▸ CNR1 P21554 2/20 0.41
▸ CNR2 P34972 2/20 0.41
▸ TRPV1 Q8NER1 2/20 0.41

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
SCHEMBL16509348 0.95 MAPK1 (0.49) TLR4MAPK1LY96GJB2
SCHEMBL16509346 0.92 TLR4 (0.46) TLR4MAPK1SELPLY96GJB2
SCHEMBL2741377 0.89 MAPK1 (0.50) TLR4MAPK1SELPLY96
SCHEMBL2741376 0.89 MAPK1 (0.50) TLR4MAPK1SELPLY96
SCHEMBL16160412 0.88 TLR4 (0.49) TLR4MAPK1SELPLY96GJB2
SCHEMBL16160411 0.88 TLR4 (0.49) TLR4MAPK1SELPLY96GJB2
SCHEMBL16433864 0.88 MAPK1 (0.54) TLR4MAPK1LY96
SCHEMBL20685510 0.88 MAPK1 (0.54) TLR4MAPK1LY96
SCHEMBL22006236 0.88 MAPK1 (0.54) TLR4MAPK1LY96
SCHEMBL16502193 0.88 MAPK1 (0.54) TLR4MAPK1LY96

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160137681-A1 LIPOCHITO-OLIGOSACCHARIDES STIMULATING ARBUSCULAR MYCORRHIZAL SYMBIOSIS INSTITUT NATIONAL DE RECHERCHE POUR L'AGRICULTURE, L'ALIMENTATION ET L'ENVIRONNEMENT (FR) 2016-05-19 — — US disclosed
US-9241454-B2 Lipochito-oligosaccharides stimulating arbuscular mycorrhizal symbiosis INSTITUT NATIONAL DE LA RECHERCHE AGRONOMIQUE (FR) 2016-01-26 — — US disclosed
US-20110301032-A1 Lipochito-Oligosaccharides Stimulating Arbuscular Mycorrhizal Symbiosis INSTITUT NATIONAL DE RECHERCHE POUR L'AGRICULTURE, L'ALIMENTATION ET L'ENVIRONNEMENT (FR) 2011-12-08 — — 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-20160137681-A1 LIPOCHITO-OLIGOSACCHARIDES STIMULATING ARBUSCULAR MYCORRHIZAL SYMBIOSIS LSS, ERG28, CHIT1 TLR4 78/4885MAPK1 824/4885SELP 2784/4885
US-20110301032-A1 Lipochito-Oligosaccharides Stimulating Arbuscular Mycorrhizal Symbiosis LSS, ERG28, CHIT1 TLR4 78/4885MAPK1 824/4885SELP 2784/4885

“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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