SCHEMBL20454151

SCHEMBL20454151

OC[C@H]1O[C@@H](S[C@@H]2O[C@H](CO)[C@H](O)[C@H](n3cc(-c4ccc(F)cc4)nn3)[C@H]2O)[C@H](O)[C@@H](n2cc(-c3ccc(F)cc3)nn2)[C@H]1O

nearest known ligand 0.88

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 20/20 0.88
LGALS1 P09382 13/20 0.88
LGALS8 O00214 1/20 0.79

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
SCHEMBL18425041 1.00 LGALS3 (0.88) LGALS3LGALS1LGALS8
Olitigaltin SCHEMBL19848047 0.88 LGALS3 (1.00) LGALS3LGALS1LGALS8
Olitigaltin SCHEMBL15657272 0.88 LGALS3 (1.00) LGALS3LGALS1LGALS8
Olitigaltin SCHEMBL18556517 0.88 LGALS3 (1.00) LGALS3LGALS1LGALS8
Olitigaltin SCHEMBL17163850 0.88 LGALS3 (1.00) LGALS3LGALS1LGALS8
Olitigaltin SCHEMBL23939583 0.88 LGALS3 (1.00) LGALS3LGALS1LGALS8
Olitigaltin SCHEMBL19630648 0.88 LGALS3 (1.00) LGALS3LGALS1LGALS8
Olitigaltin SCHEMBL19005446 0.88 LGALS3 (1.00) LGALS3LGALS1LGALS8
Olitigaltin SCHEMBL19680604 0.88 LGALS3 (1.00) LGALS3LGALS1LGALS8
Olitigaltin SCHEMBL17432857 0.88 LGALS3 (1.00) LGALS3LGALS1LGALS8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10799522-B2 Compositions and methods relating to galectin detection WAYNE STATE UNIVERSITY (US) 2020-10-13 US disclosed
US-20180221400-A1 COMPOSITIONS AND METHODS RELATING TO GALECTIN DETECTION WAYNE STATE UNIVERSITY 2018-08-09 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-10799522-B2 Compositions and methods relating to galectin detection LGALS1, LGALS2, LGALS3 LGALS3 3/4885LGALS1 1/4885LGALS8 6/4885
US-20180221400-A1 COMPOSITIONS AND METHODS RELATING TO GALECTIN DETECTION LGALS1, LGALS2, LGALS3 LGALS3 3/4885LGALS1 1/4885LGALS8 6/4885

“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.