SCHEMBL3766673

SCHEMBL3766673

Cn1cc(C#Cc2c(N3CCOCC3)sc3c2CC(C)(C)CC3=O)cn1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 12/20 0.43
PIK3CD O00329 3/20 0.43
PIK3CB P42338 3/20 0.43
PIK3CG P48736 3/20 0.43
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GRM5 P41594 2/20 0.34
ALK Q9UM73 1/20 0.34
BRD4 O60885 1/20 0.33
LRRK2 Q5S007 1/20 0.33
PIK3R1 P27986 2/20 0.32
HTT P42858 1/20 0.32
HIF1A Q16665 1/20 0.32
MAPT P10636 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL3763708 0.85 PIK3CA (0.44) PIK3CAPIK3CDPIK3CBPIK3CGALDH1A1
SCHEMBL3760022 0.84 PIK3CA (0.43) PIK3CAPIK3CDPIK3CBPIK3CGALDH1A1
SCHEMBL3759332 0.84 PIK3CA (0.44) PIK3CAPIK3CDPIK3CBPIK3CGALDH1A1
SCHEMBL3754871 0.84 PIK3CA (0.43) PIK3CAPIK3CDPIK3CBPIK3CGALDH1A1
SCHEMBL3763838 0.83 PIK3CA (0.42) PIK3CAPIK3CDPIK3CBPIK3CGALDH1A1
SCHEMBL3763646 0.83 PIK3CA (0.41) PIK3CAPIK3CDPIK3CBPIK3CGGRM5
SCHEMBL3759706 0.82 PIK3CA (0.43) PIK3CAPIK3CDPIK3CBPIK3CGALDH1A1
SCHEMBL3764957 0.82 PIK3CA (0.42) PIK3CAPIK3CDPIK3CBPIK3CGALDH1A1
SCHEMBL3759747 0.82 PIK3CA (0.41) PIK3CAPIK3CDPIK3CBPIK3CGPIK3R1
SCHEMBL3762562 0.82 PIK3CA (0.42) PIK3CAPIK3CDPIK3CBPIK3CGALDH1A1

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
EP-2029570-B1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2014-10-15 EP disclosed
US-8324204-B2 Fused thiophene derivatives as kinase inhibitors UCB PHARMA SA (BE) 2012-12-04 US disclosed
US-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2010-12-02 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-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors PIKFYVE, PI4KA, PIK3CA PIK3CA 3/4885PIK3CD 9/4885PIK3CB 11/4885

“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.