SCHEMBL24673805

SCHEMBL24673805

COC(=O)c1ccc2sc(SC)cc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.47
PIK3CA P42336 1/20 0.44
PIK3CB P42338 1/20 0.44
PIK3CG P48736 1/20 0.44
PI4KB Q9UBF8 1/20 0.44
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
CA14 Q9ULX7 2/20 0.44
XDH P47989 1/20 0.44
LCK P06239 1/20 0.43
SMN1; SMN2 Q16637 6/20 0.43
MAPT P10636 6/20 0.43
KDM4E B2RXH2 4/20 0.43
KMT2A Q03164 4/20 0.43
HTT P42858 3/20 0.43
HPGD P15428 3/20 0.43
LMNA P02545 3/20 0.43

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
SCHEMBL25260378 0.88 HDAC1 (0.61) HDAC1PIK3CAPIK3CBPIK3CGPI4KB
SCHEMBL15697489 0.80 HDAC1 (0.61) HDAC1PIK3CAPIK3CBPIK3CGPI4KB
SCHEMBL19029299 0.80 HDAC1 (0.50) HDAC1PIK3CAPIK3CBPIK3CGPI4KB
SCHEMBL6299396 0.80 HDAC1 (0.50) HDAC1PIK3CAPIK3CBPIK3CGPI4KB
SCHEMBL31095469 0.78 HDAC1 (0.52) HDAC1PIK3CAPIK3CBPIK3CGPI4KB
SCHEMBL1883961 0.78 HDAC1 (0.60) HDAC1PIK3CAPIK3CBPIK3CGPI4KB
SCHEMBL18936014 0.78 HDAC1 (0.49) HDAC1PIK3CAPIK3CBPIK3CGPI4KB
SCHEMBL24673803 0.78 HDAC1 (0.49) HDAC1PIK3CAPIK3CBPIK3CGPI4KB
SCHEMBL9612670 0.77 CLK1 (0.59) HDAC1PIK3CAPIK3CBPIK3CGPI4KB
SCHEMBL12365630 0.76 HDAC1 (0.47) HDAC1PIK3CAPIK3CBPIK3CGPI4KB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340570-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2022-10-27 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 (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-20220340570-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 HDAC1 502/4885PIK3CA 142/4885PIK3CB 239/4885

“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.