SCHEMBL5154901

SCHEMBL5154901

Nc1ccn([C@@H]2O[C@H](C(O)=S=O)[C@@H](O)[C@H]2O)c(=O)n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.62
THRB P10828 1/20 0.62
MTOR P42345 1/20 0.62
MDM2 Q00987 1/20 0.62
NCOA1 Q15788 1/20 0.62
NCOA3 Q9Y6Q9 1/20 0.62
NT5E P21589 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.45
ST6GAL1 P15907 1/20 0.44
TSHR P16473 1/20 0.44
GLA P06280 1/20 0.44
P2RY2 P41231 1/20 0.44
PDE3A Q14432 2/20 0.44
PDE4D Q08499 1/20 0.44
SLC29A1 Q99808 1/20 0.44
CACNA1F O60840 1/20 0.42
ALB P02768 1/20 0.42
MAPT P10636 1/20 0.42
CACNA1D Q01668 1/20 0.42
CACNA1S Q13698 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
SCHEMBL3266289 0.87 LMNA (0.64) LMNATHRBMTORMDM2NCOA1
SCHEMBL1981224 0.86 LMNA (0.63) LMNATHRBMTORMDM2NCOA1
Hydrochloric Acid SCHEMBL6946856 0.85 LMNA (0.62) LMNATHRBMTORMDM2NCOA1
SCHEMBL3404713 0.84 LMNA (0.60) LMNATHRBMTORMDM2NCOA1
SCHEMBL635860 0.84 LMNA (0.60) LMNATHRBMTORMDM2NCOA1
SCHEMBL27267985 0.84 LMNA (0.60) LMNATHRBMTORMDM2NCOA1
SCHEMBL3662232 0.82 LMNA (0.59) LMNATHRBMTORMDM2NCOA1
SCHEMBL3630055 0.82 LMNA (0.59) LMNATHRBMTORMDM2NCOA1
SCHEMBL3867213 0.82 LMNA (0.59) LMNATHRBMTORMDM2NCOA1
SCHEMBL3662233 0.82 LMNA (0.59) LMNATHRBMTORMDM2NCOA1

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
EP-1585955-A4 USE OF ISOGENIC HUMAN CANCER CELLS FOR HIGH-THROUGHPUT SCREENING AND DRUG DISCOVERY UNIV JOHNS HOPKINS (US) 2007-04-18 EP disclosed
US-20050239051-A1 Use of isogenic human cancer cells for high-throughput screening and drug discovery THE JOHNS HOPKINS UNIVERSITY (US) 2005-10-27 US disclosed
EP-1585955-A2 USE OF ISOGENIC HUMAN CANCER CELLS FOR HIGH-THROUGHPUT SCREENING AND DRUG DISCOVERY The Johns Hopkins University, School of Medicine, Office of Technology Licencing (US) 2005-10-19 EP disclosed
US-20030069256-A1 Use of isogenic human cancer cells for high-throughput screening and drug discovery NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-04-10 US disclosed
WO-2003027632-A2 USE OF ISOGENIC HUMAN CANCER CELLS FOR HIGH-THROUGHPUT SCREENING AND DRUG DISCOVERY THE JOHNS HOPKINS UNIVERSITY (US) 2003-04-03 WO 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-20030069256-A1 Use of isogenic human cancer cells for high-throughput screening and drug discovery TP53, BRCA1, MCL1 LMNA 4035/4885THRB 2895/4885MTOR 3225/4885

“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.