SCHEMBL11913249

SCHEMBL11913249

O=C(O)C(F)(F)[C@@H]1O[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 1/20 0.54
▸ PTPN1 P18031 11/20 0.49
▸ CDC25B P30305 9/20 0.49
▸ PTPN2 P17706 6/20 0.49
▸ PTPN11 Q06124 6/20 0.49
▸ PTPN6 P29350 5/20 0.49
▸ TACR2 P21452 3/20 0.48
▸ SSTR1 P30872 1/20 0.46
▸ SSTR2 P30874 1/20 0.46
▸ SSTR4 P31391 1/20 0.46
▸ SSTR3 P32745 1/20 0.46
▸ SSTR5 P35346 1/20 0.46
▸ HTR1A P08908 1/20 0.45
▸ CDC25A P30304 1/20 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
SCHEMBL11913250 1.00 NT5E (0.54) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL13599703 1.00 NT5E (0.54) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL15873498 1.00 NT5E (0.54) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL15873543 1.00 NT5E (0.54) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL15873499 1.00 NT5E (0.54) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL17320861 0.90 NT5E (0.52) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL15873553 0.87 TACR2 (0.54) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL15873551 0.87 TACR2 (0.54) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL15873531 0.87 TACR2 (0.54) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL18393101 0.87 TACR2 (0.54) NT5EPTPN1CDC25BPTPN2PTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3530663-B1 PROCESS FOR PREPARING GEM-DIFLUORINATED C-GLYCOSIDE COMPOUNDS SUNSHINE BIOPHARMA INC (CA) 2021-08-11 — — EP disclosed
EP-3530663-A1 PROCESS FOR PREPARING GEM-DIFLUORINATED C-GLYCOSIDE COMPOUNDS Advanomics Corp. (CA) 2019-08-28 — — EP disclosed
EP-3530663-A1 PROCESS FOR PREPARING GEM-DIFLUORINATED C-GLYCOSIDE COMPOUNDS Advanomics Corp. (CA) 2019-08-28 — — EP disclosed
US-10272065-B2 Gem-difluorinated C-glycoside compounds as anti-cancer agents Benoit & Côté (CA) 2019-04-30 — — US disclosed
US-10272065-B2 Gem-difluorinated C-glycoside compounds as anti-cancer agents Benoit & Côté (CA) 2019-04-30 — — US disclosed
US-20150353573-A1 GEM-DIFLUORINATED C-GLYCOSIDE COMPOUNDS AS ANTI-CANCER AGENTS ADVANOMICS CORPORATION (CA) 2015-12-10 — — US disclosed
EP-2943497-A1 GEM-DIFLUORINATED C-GLYCOSIDE COMPOUNDS AS ANTI-CANCER AGENTS Advanomics Corp. (CA) 2015-11-18 — — EP disclosed
WO-2014107803-A1 GEM-DIFLUORINATED C-GLYCOSIDE COMPOUNDS AS ANTI-CANCER AGENTS ADVANOMICS CORPORATION (CA) 2014-07-17 — — WO disclosed
US-8236935-B2 Gem-difluorinated C-glycoside compounds derived from podophyllotoxin, their preparation and their applications INSTITUT NATIONAL DES SCIENCES APPLIQUEES DE ROUEN (INSA) (FR) 2012-08-07 — — US disclosed
US-20090318675-A1 NOVEL GEM-DIFLUORINATED C-GLYCOSIDE COMPOUNDS DERIVED FROM PODOPHYLLOTOXIN, THEIR PREPARATION AND THEIR APPLICATIONS SUNSHINE BIOPHARMA INC. (CA) 2009-12-24 — — 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 (3 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-20150353573-A1 GEM-DIFLUORINATED C-GLYCOSIDE COMPOUNDS AS ANTI-CANCER AGENTS GMNN, DDOST, MAGT1 NT5E 3883/4885PTPN1 2020/4885CDC25B 253/4885
US-20090318675-A1 NOVEL GEM-DIFLUORINATED C-GLYCOSIDE COMPOUNDS DERIVED FROM PODOPHYLLOTOXIN, THEIR PREPARATION AND THEIR APPLICATIONS GLRA3, GMNN, B3GAT3 NT5E 4331/4885PTPN1 962/4885CDC25B 1093/4885
US-10272065-B2 Gem-difluorinated C-glycoside compounds as anti-cancer agents GMNN, DDOST, MAGT1 NT5E 3883/4885PTPN1 2020/4885CDC25B 253/4885

“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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