SCHEMBL26349835

SCHEMBL26349835

O=C(CCCCOC1OC(CO)C(O)C(O)C1O)NCCCNC(=O)CCOCC(COCCC(=O)NCCCNC(=O)CCCCOC1OC(CO)C(O)C(O)C1O)(COCCC(=O)NCCCNC(=O)CCCCOC1OC(CO)C(O)C(O)C1O)NC(=O)OCc1ccccc1

nearest known ligand 0.90

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.39
▸ SLC6A2 P23975 2/20 0.38
▸ LGALS8 O00214 1/20 0.38
▸ SLC5A1 P13866 1/20 0.36
▸ SLC5A2 P31639 1/20 0.36
▸ HTT P42858 1/20 0.36

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
SCHEMBL30634609 0.91 MAPK1 (0.46) LGALS8
SCHEMBL30587044 0.91 MAPK1 (0.46) LGALS8
SCHEMBL26350758 0.88 MAPK1 (0.43) LGALS8
SCHEMBL17448300 0.85 TACR1 (0.38) HTT
SCHEMBL17640891 0.85 TACR1 (0.38) HTT
SCHEMBL16693722 0.85 TACR1 (0.38) HTT
SCHEMBL17448328 0.85 TACR1 (0.38) HTT
SCHEMBL20510352 0.84 LGALS8 (0.42) MAOBSLC6A2LGALS8SLC5A1SLC5A2
SCHEMBL30391620 0.83 HTT (0.46) MAOBLGALS8HTT
SCHEMBL30891325 0.83 HTT (0.46) MAOBLGALS8HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230303618-A1 TRIPTOLIDE CONJUGATES AND USES THEREOF REYOUNG CORPORATION (US) 2023-09-28 — — 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 (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-20230303618-A1 TRIPTOLIDE CONJUGATES AND USES THEREOF TLR9, XIAP, ENPP2 MAOB 1900/4885SLC6A2 3027/4885LGALS8 64/4885

“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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