SCHEMBL4198692

SCHEMBL4198692

C[C@H]1COCCN1c1cc(CS(=O)(=O)c2cccc(F)c2)nc(Cl)n1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 10/20 0.50
PIK3CD O00329 4/20 0.50
MTOR P42345 6/20 0.44
POLB P06746 1/20 0.43
CHEK1 O14757 7/20 0.42
ATR Q13535 7/20 0.42
PDCD1 Q15116 7/20 0.42
ATRIP Q8WXE1 7/20 0.42
CD274 Q9NZQ7 7/20 0.42
PIK3C3 Q8NEB9 2/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL3601143 0.90 PIK3CA (0.46) PIK3CAPIK3CDMTORPOLBCHEK1
SCHEMBL3597871 0.89 PIK3CA (0.50) PIK3CAPIK3CDMTORPOLBCHEK1
SCHEMBL739607 0.89 PIK3CA (0.52) PIK3CAPIK3CDMTORPOLBCHEK1
SCHEMBL4201332 0.88 POLB (0.48) PIK3CAPIK3CDMTORPOLBCHEK1
SCHEMBL4206582 0.87 POLB (0.47) PIK3CAPIK3CDMTORPOLBCHEK1
SCHEMBL4194610 0.87 PIK3CA (0.44) PIK3CAPIK3CDMTORPOLBCHEK1
SCHEMBL4301766 0.87 POLB (0.47) PIK3CAPIK3CDMTORPOLBCHEK1
SCHEMBL4203833 0.86 PIK3CA (0.47) PIK3CAPIK3CDMTORCHEK1ATR
SCHEMBL3596530 0.85 POLB (0.59) PIK3CAPIK3CDMTORPOLBCHEK1
SCHEMBL4211899 0.84 POLB (0.53) PIK3CAPIK3CDMTORPOLBCHEK1

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-20090018134-A1 Compounds - 945 ASTRAZENECA AB (SE) 2009-01-15 US disclosed
US-20090018134-A1 Compounds - 945 ASTRAZENECA AB (SE) 2009-01-15 US disclosed
US-20090018134-A1 Compounds - 945 ASTRAZENECA AB (SE) 2009-01-15 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-20090018134-A1 Compounds - 945 MTOR, PIK3CA, PIK3R5 PIK3CA 2/4885PIK3CD 4/4885MTOR 1/4885

“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.