SCHEMBL3759330

SCHEMBL3759330

CC1(C)CC(=O)c2sc(N3CCOCC3)c(-c3cccc(CN4CCCCC4)c3)c2C1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PSMB8 P28062 1/20 0.41
PIK3CA P42336 5/20 0.37
PIK3CD O00329 3/20 0.37
PIK3CB P42338 3/20 0.37
PIK3CG P48736 3/20 0.37
HRH3 Q9Y5N1 3/20 0.37
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
BRD4 O60885 1/20 0.36
PRKDC P78527 2/20 0.35
NCF1 P14598 1/20 0.35
CHRM3 P20309 1/20 0.35
PARP1 P09874 1/20 0.34

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
SCHEMBL3760242 0.91 PSMB8 (0.38) PSMB8PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL3760623 0.88 PSMB8 (0.41) PSMB8PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL3754652 0.87 PIK3CA (0.40) PIK3CAPIK3CDPIK3CBPIK3CGALDH1A1
SCHEMBL3759346 0.85 AOC3 (0.39) PIK3CAPIK3CDPIK3CBPIK3CGSMN1; SMN2
SCHEMBL3763305 0.85 CXCR4 (0.42) PSMB8CHRM3
SCHEMBL3759336 0.85 PSMB8 (0.37) PSMB8PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL3758928 0.85 ALDH1A1 (0.39) PIK3CAPIK3CDPIK3CBPIK3CGALDH1A1
SCHEMBL3766694 0.84 CXCR4 (0.38) PSMB8PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL3751935 0.84 AOC3 (0.40) PIK3CAPIK3CDPIK3CBPIK3CGBRD4
SCHEMBL3754902 0.83 PSMB8 (0.35) PSMB8PIK3CAPIK3CDPIK3CBPIK3CG

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 PSMB8 2451/4885PIK3CA 3/4885PIK3CD 9/4885

“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.