SCHEMBL623632

SCHEMBL623632

N=C1NC(=O)/C(=C/c2ccc(-c3ccccc3F)o2)S1

nearest known ligand 0.78

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 5/20 0.78
GSK3B P49841 10/20 0.74
GSK3A P49840 9/20 0.74
CDK2 P24941 4/20 0.69
PIK3CA P42336 2/20 0.57
PIK3CB P42338 1/20 0.57
INSR P06213 1/20 0.56
IGF1R P08069 1/20 0.56
MEN1 O00255 1/20 0.56
POLB P06746 1/20 0.56
BLM P54132 1/20 0.56
KMT2A Q03164 1/20 0.56
PDK1 Q15118 1/20 0.56
NR2E3 Q9Y5X4 1/20 0.56

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
SCHEMBL623633 1.00 PIK3CG (0.78) PIK3CGGSK3BGSK3ACDK2PIK3CA
SCHEMBL622799 0.86 PIK3CG (0.80) PIK3CGGSK3BGSK3APIK3CAPIK3CB
SCHEMBL622801 0.86 PIK3CG (0.80) PIK3CGGSK3BGSK3APIK3CAPIK3CB
SCHEMBL622800 0.86 PIK3CG (0.80) PIK3CGGSK3BGSK3APIK3CAPIK3CB
SCHEMBL623772 0.85 GSK3B (1.00) PIK3CGGSK3BGSK3ACDK2PIK3CA
SCHEMBL623771 0.85 GSK3B (1.00) PIK3CGGSK3BGSK3ACDK2PIK3CA
SCHEMBL10118549 0.85 GSK3B (0.70) PIK3CGGSK3BGSK3ACDK2PIK3CA
SCHEMBL15313049 0.85 GSK3B (0.70) PIK3CGGSK3BGSK3ACDK2PIK3CA
SCHEMBL622538 0.82 PIK3CG (0.79) PIK3CGGSK3BGSK3ACDK2PIK3CA
SCHEMBL622537 0.82 PIK3CG (0.79) PIK3CGGSK3BGSK3ACDK2PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9598395-B2 Premature-termination-codons readthrough compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-03-21 US disclosed
US-9598395-B2 Premature-termination-codons readthrough compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-03-21 US disclosed
US-9255088-B2 Premature-termination-codons readthrough compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-02-09 US disclosed
US-9255088-B2 Premature-termination-codons readthrough compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-02-09 US disclosed
US-20150051251-A1 PREMATURE-TERMINATION-CODONS READTHROUGH COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-02-19 US disclosed
US-20150051251-A1 PREMATURE-TERMINATION-CODONS READTHROUGH COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-02-19 US disclosed
US-20130274283-A1 PREMATURE-TERMINATION-CODONS READTHROUGH COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-10-17 US disclosed
US-20130274283-A1 PREMATURE-TERMINATION-CODONS READTHROUGH COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-10-17 US disclosed
US-20130274283-A1 PREMATURE-TERMINATION-CODONS READTHROUGH COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-10-17 US disclosed
WO-2012021707-A2 PREMATURE-TERMINATION-CODONS READTHROUGH COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-02-16 WO disclosed
WO-2012021707-A2 PREMATURE-TERMINATION-CODONS READTHROUGH COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-02-16 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 (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-20130274283-A1 PREMATURE-TERMINATION-CODONS READTHROUGH COMPOUNDS UPF1, NUDT21, RNGTT PIK3CG 3728/4885GSK3B 4721/4885GSK3A 4773/4885
US-20150051251-A1 PREMATURE-TERMINATION-CODONS READTHROUGH COMPOUNDS UPF1, NUDT21, RNGTT PIK3CG 3728/4885GSK3B 4721/4885GSK3A 4773/4885

“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.