SCHEMBL2462263

SCHEMBL2462263

O=c1[nH]nc2ccc(Cl)cn12

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.48
NOTUM Q6P988 10/20 0.46
PARP1 P09874 1/20 0.41
GSK3B P49841 3/20 0.38
PRMT5 O14744 1/20 0.37
WDR77 Q9BQA1 1/20 0.37
GSK3A P49840 2/20 0.36
TLR8 Q9NR97 1/20 0.36
POLB P06746 2/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL18632542 0.86 SCN5A (0.61) SCN5ANOTUMALDH1A1
SCHEMBL20772490 0.77 SCN5A (0.51) SCN5ANOTUMPRMT5WDR77
SCHEMBL5254089 0.77 SCN5A (0.48) SCN5ANOTUM
SCHEMBL18632525 0.76 SCN5A (0.51) SCN5ANOTUMGSK3B
SCHEMBL3793191 0.75 SCN5A (0.43) SCN5ANOTUMALDH1A1
SCHEMBL18632513 0.74 SCN5A (0.49) SCN5ANOTUM
SCHEMBL20772287 0.73 NOTUM (0.39) SCN5ANOTUMGSK3BGSK3ATLR8
SCHEMBL18655673 0.73 SCN5A (0.44) SCN5ANOTUM
SCHEMBL406976 0.73 SCN5A (0.48) SCN5ANOTUMGSK3BGSK3A
SCHEMBL6724420 0.73 SCN5A (0.55) SCN5ANOTUMPOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8575114-B2 SGLT-2 inhibitors, methods of making them, and uses thereof ALBANY MOLECULAR RESEARCH, INC. (US) 2013-11-05 US disclosed
US-20110237527-A1 SGLT-2 INHIBITORS, METHODS OF MAKING THEM, AND USES THEREOF ALBANY MOLECULAR RESEARCH, INC. (US) 2011-09-29 US disclosed
EP-1333031-A1 BICYCLIC TRIAZOLONE DERIVATIVES AND HERBICIDES CONTAINING THE SAME Sumitomo Chemical Takeda Agro Company, Limited (JP) 2003-08-06 EP 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-20110237527-A1 SGLT-2 INHIBITORS, METHODS OF MAKING THEM, AND USES THEREOF SLC5A2, SLC5A1, SLC10A1 SCN5A 692/4885NOTUM 1165/4885PARP1 3304/4885

“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.