SCHEMBL3817822

SCHEMBL3817822

Cc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 12/20 0.65
LGALS9 O00182 6/20 0.65
LGALS1 P09382 6/20 0.65
LGALS7; LGALS7B P47929 5/20 0.65
LGALS8 O00214 3/20 0.51
LGALS4 P56470 3/20 0.51
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA4 P22748 1/20 0.45
CA5A P35218 1/20 0.45
CA7 P43166 1/20 0.45
CA5B Q9Y2D0 1/20 0.45
SSTR4 P31391 2/20 0.44
SSTR5 P35346 2/20 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
SCHEMBL17154133 0.92 LGALS3 (0.60) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL17154143 0.92 LGALS3 (0.60) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL19674440 0.91 LGALS3 (0.58) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL19674473 0.91 LGALS3 (0.58) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL5899337 0.91 LGALS3 (0.56) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL16623018 0.90 LGALS3 (0.57) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL7023852 0.89 LGALS3 (0.52) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL7024531 0.89 LGALS3 (0.52) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL5899315 0.86 LGALS3 (0.57) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL19090197 0.85 LGALS3 (0.80) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7635685-B2 Bifunctional antibiotics for targeting rRNA and resistance-causing enzymes and for inhibition of anthrax lethal factor TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2009-12-22 US disclosed
EP-1789429-B1 BIFUNCTIONAL ANTIBIOTICS FOR TARGETING RRNA AND RESISTANCE CAUSING ENZYMES AND FOR INHIBITION OF ANTHRAX LETHAL FACTOR TECHNION RES & DEV FOUNDATION (IL) 2009-08-26 EP disclosed
EP-1789429-A2 BIFUNCTIONAL ANTIBIOTICS FOR TARGETING RRNA AND RESISTANCE CAUSING ENZYMES AND FOR INHIBITION OF ANTHRAX LETHAL FACTOR TECHNION RESEARCH AND DEVELOPMENT FOUNDATION, LTD. (IL) 2007-05-30 EP disclosed
WO-2006027784-A2 BIFUNCTIONAL ANTIBIOTICS FOR TARGETING RRNA AND RESISTANCE CAUSING ENZYMES AND FOR INHIBITION OF ANTHRAX LETHAL FACTOR TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2006-03-16 WO disclosed
US-20050148522-A1 Bifunctional antibiotics for targeting rRNA and resistance-causing enzymes and for inhibition of anthrax lethal factor TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. 2005-07-07 US disclosed
US-20050004052-A1 Bifunctional antibiotics for targeting rRNA and resistance-causing enzymes TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. 2005-01-06 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-20050148522-A1 Bifunctional antibiotics for targeting rRNA and resistance-causing enzymes and for inhibition of anthrax lethal factor ANTXR2, RNASEH1, RNASEL LGALS3 3941/4885LGALS9 3185/4885LGALS1 3490/4885
US-20050004052-A1 Bifunctional antibiotics for targeting rRNA and resistance-causing enzymes EMG1, FBL, RRM2B LGALS3 4310/4885LGALS9 4004/4885LGALS1 4215/4885

“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.