SCHEMBL3759220

SCHEMBL3759220

CC1(C)Cc2c(sc(N3CCOCC3)c2-c2ccnc(Cl)c2)C(=O)N1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 12/20 0.45
PIK3CG P48736 12/20 0.45
PIK3CA P42336 8/20 0.45
PIK3CB P42338 8/20 0.45
HTT P42858 1/20 0.37
HIF1A Q16665 1/20 0.37
LRRK2 Q5S007 1/20 0.36
ATR Q13535 1/20 0.35
ATRIP Q8WXE1 1/20 0.35
MTOR P42345 1/20 0.35
PARP10 Q53GL7 1/20 0.34
PARP11 Q9NR21 1/20 0.34
BUB1 O43683 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
SCHEMBL3760314 0.87 PIK3CD (0.42) PIK3CDPIK3CGPIK3CAPIK3CBHTT
SCHEMBL3764807 0.85 PIK3CA (0.43) PIK3CDPIK3CGPIK3CAPIK3CBHTT
SCHEMBL3760006 0.83 PRKDC (0.39) PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL3765884 0.83 PRKDC (0.41) PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL3757723 0.82 PIK3CA (0.37) PIK3CDPIK3CGPIK3CAPIK3CBHIF1A
SCHEMBL3761662 0.82 PRKDC (0.45) PIK3CDPIK3CGPIK3CAPIK3CBHTT
SCHEMBL3770912 0.81 PIK3CA (0.39) PIK3CDPIK3CGPIK3CAPIK3CBLRRK2
SCHEMBL3761788 0.81 HTR7 (0.41) PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL3761312 0.81 LRRK2 (0.41) PIK3CDPIK3CGPIK3CAPIK3CBLRRK2
SCHEMBL13805581 0.80 PIK3CD (0.37) PIK3CDPIK3CGPIK3CAPIK3CBHTT

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 5 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
EP-2029570-A1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB Pharma S.A. (BE) 2009-03-04 EP disclosed
WO-2007141504-A1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2007-12-13 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 (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 PIK3CD 9/4885PIK3CG 12/4885PIK3CA 3/4885

“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.