SCHEMBL3501682

SCHEMBL3501682

O=S(=O)(O)c1cc(O)c2c(S(=O)(=O)O)cc(S(=O)(=O)O)cc2c1.[NaH].[NaH]

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NT5E P21589 3/20 0.62
PRMT1 Q99873 2/20 0.54
PTPN1 P18031 2/20 0.50
APEX1 P27695 1/20 0.47
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 3/20 0.46
ALDH1A1 P00352 3/20 0.46
CYP2C19 P33261 2/20 0.46
HSD17B10 Q99714 2/20 0.46
HIF1A Q16665 1/20 0.46
NSD2 O96028 3/20 0.45
MAPK1 P28482 2/20 0.45
DNASE1L3 Q13609 1/20 0.45
CASP6 P55212 3/20 0.45
DUSP3 P51452 2/20 0.45
PTPN5 P54829 2/20 0.45
PTPN11 Q06124 2/20 0.45
DUSP5 Q16690 1/20 0.42
CASP7 P55210 1/20 0.42
SUMO2 P61956 1/20 0.41

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
SCHEMBL29677235 0.98 NT5E (0.65) NT5EPRMT1PTPN1APEX1CYP1A2
SCHEMBL2928135 0.98 NT5E (0.65) NT5EPRMT1PTPN1APEX1CYP1A2
SCHEMBL29677298 0.98 NT5E (0.65) NT5EPRMT1PTPN1APEX1CYP1A2
SCHEMBL28019677 0.89 NT5E (0.54) NT5EPRMT1PTPN1APEX1CYP1A2
SCHEMBL9805944 0.88 NT5E (0.71) NT5EPRMT1PTPN1APEX1CYP1A2
SCHEMBL564556 0.88 NT5E (0.71) NT5EPRMT1PTPN1APEX1CYP1A2
SCHEMBL9340309 0.86 NT5E (0.65) NT5EPRMT1PTPN1APEX1CYP1A2
SCHEMBL564558 0.86 NT5E (0.74) NT5EPRMT1PTPN1APEX1CYP1A2
SCHEMBL11502500 0.86 NT5E (0.74) NT5EPRMT1PTPN1APEX1CYP1A2
SCHEMBL66310 0.86 NT5E (0.74) NT5EPRMT1PTPN1APEX1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160067257-A1 SCREENING METHOD AND COMPOUNDS FOR MODULATING TELOMERASE ACTIVITY THE WISTAR INSTITUTE (US) 2016-03-10 US disclosed
US-9234230-B2 Screening method and compounds for modulating telomerase activity THE WISTAR INSTITUTE (US) 2016-01-12 US disclosed
US-8377992-B2 TRBD-binding effectors and methods for using the same to modulate telomerase activity THE WISTAR INSTITUTE (US) 2013-02-19 US disclosed
US-20120309759-A1 Screening Method and Compounds for Modulating Telomerase Activity THE WISTAR INSTITUTE (US) 2012-12-06 US disclosed
US-20100160260-A1 TRBD-Binding Effectors and Methods for Using the Same to Modulate Telomerase Activity THE WISTAR INSTITUTE 2010-06-24 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 (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-20120309759-A1 Screening Method and Compounds for Modulating Telomerase Activity TERT, TERB1, TERF2 NT5E 1016/4885PRMT1 774/4885PTPN1 2426/4885
US-20160067257-A1 SCREENING METHOD AND COMPOUNDS FOR MODULATING TELOMERASE ACTIVITY TERT, TERB1, TERF2 NT5E 1016/4885PRMT1 774/4885PTPN1 2426/4885

“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.