SCHEMBL25890816

SCHEMBL25890816

Cc1nc2c(ncn2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3OC(CNC(=O)CCOCCOCCOCCOCCNC(=O)CCCC[C@@H]4SC[C@@H]5NC(=O)N[C@@H]54)[C@@H](O)[C@H](O)C3O)C(O)[C@@H]2O)c(=O)[nH]1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HLCS P50747 3/20 0.51
▸ KRAS P01116 9/20 0.50
▸ HINT1 P49773 1/20 0.47
▸ FUT5 Q11128 1/20 0.46
▸ F2 P00734 2/20 0.43
▸ TGM2 P21980 1/20 0.42
▸ PRSS1 P07477 1/20 0.42
▸ PRSS2 P07478 1/20 0.42
▸ PRSS3 P35030 1/20 0.42
▸ TPSAB1 Q15661 1/20 0.42
▸ B4GALT1 P15291 1/20 0.42

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
SCHEMBL25893248 0.94 KRAS (0.57) HLCSKRASHINT1FUT5F2
SCHEMBL25890806 0.90 HLCS (0.48) HLCSKRASHINT1FUT5F2
SCHEMBL25893244 0.85 FUT6 (0.53) HLCSKRASFUT5F2TGM2
SCHEMBL25891100 0.83 KRAS (0.52) KRASFUT5TGM2B4GALT1
SCHEMBL25890782 0.83 KRAS (0.52) KRASFUT5TGM2B4GALT1
SCHEMBL14204794 0.81 HLCS (0.69) HLCSHINT1
SCHEMBL14204804 0.81 HLCS (0.69) HLCSHINT1
SCHEMBL14204815 0.81 KRAS (0.60) HLCSKRASHINT1FUT5F2
SCHEMBL14204813 0.81 KRAS (0.60) HLCSKRASHINT1FUT5F2
SCHEMBL14204788 0.80 HLCS (0.72) HLCSHINT1

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-20230235082-A1 SITE-SPECIFIC ANTIBODY CONJUGATES AND THE METHODS FOR PREPARATION OF THE SAME GLYCO-THERAPY BIOTECHNOLOGY CO., LTD. (CN) 2023-07-27 — — 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-20230235082-A1 SITE-SPECIFIC ANTIBODY CONJUGATES AND THE METHODS FOR PREPARATION OF THE SAME FUT5, FUT6, SIGLEC7 HLCS 1173/4885KRAS 4257/4885HINT1 855/4885

“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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