SCHEMBL4069276

SCHEMBL4069276

COc1ccc(CNc2ncnc3cc(-c4ccc(F)cc4)sc23)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 1/20 0.62
NPC1 O15118 2/20 0.61
RAB9A P51151 2/20 0.61
EGFR P00533 7/20 0.56
KMT2A Q03164 3/20 0.55
TDP1 Q9NUW8 1/20 0.55
MEN1 O00255 2/20 0.52
POLB P06746 1/20 0.51
NR2F2 P24468 1/20 0.51
HTT P42858 1/20 0.50
MAP3K8 P41279 1/20 0.49
CLK4 Q9HAZ1 2/20 0.48
USP10 Q14694 1/20 0.48
PIK3C3 Q8NEB9 1/20 0.48
USP13 Q92995 1/20 0.48
ERBB2 P04626 2/20 0.47
LMNA P02545 2/20 0.47
USP2 O75604 1/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 1/20 0.47

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
SCHEMBL3932470 0.89 EGFR (0.59) NPC1RAB9AEGFRKMT2ATDP1
SCHEMBL4065012 0.88 TYK2 (0.66) TYK2NPC1RAB9AEGFRHTT
SCHEMBL4072924 0.87 CLK4 (0.57) NPC1RAB9AEGFRKMT2ATDP1
SCHEMBL4071062 0.85 TYK2 (0.62) TYK2NPC1RAB9AEGFRKMT2A
SCHEMBL4066517 0.85 CLK4 (0.52) NPC1RAB9AEGFRKMT2ATDP1
SCHEMBL4067913 0.84 MAP3K8 (0.52) TYK2NPC1RAB9AEGFRKMT2A
SCHEMBL4071070 0.84 EGFR (0.50) NPC1RAB9AEGFRKMT2ATDP1
SCHEMBL4064454 0.82 PDE5A (0.65) EGFRKMT2AMEN1CLK4LMNA
SCHEMBL13961313 0.82 NPC1 (0.62) TYK2NPC1RAB9AEGFRHTT
SCHEMBL4072750 0.80 EGFR (0.56) NPC1RAB9AEGFRKMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090042878-A1 THIENOPYRIMIDYLAMINES AS MODULATORS OF THE EP2 RECEPTOR BAYER SHERING PHARMA AG (DE) 2009-02-12 US claimed
EP-2014663-A1 Thieno-pyrimidyl amines as modulators of EP2 receptors Bayer Schering Pharma AG (DE) 2009-01-14 EP claimed
US-20090042878-A1 THIENOPYRIMIDYLAMINES AS MODULATORS OF THE EP2 RECEPTOR BAYER SHERING PHARMA AG (DE) 2009-02-12 US disclosed
US-20090042878-A1 THIENOPYRIMIDYLAMINES AS MODULATORS OF THE EP2 RECEPTOR BAYER SHERING PHARMA AG (DE) 2009-02-12 US disclosed
US-20090042878-A1 THIENOPYRIMIDYLAMINES AS MODULATORS OF THE EP2 RECEPTOR BAYER SHERING PHARMA AG (DE) 2009-02-12 US disclosed
WO-2009007422-A1 THIENOPYRIMIDYLAMINES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-01-15 WO disclosed
EP-2014663-A1 Thieno-pyrimidyl amines as modulators of EP2 receptors Bayer Schering Pharma AG (DE) 2009-01-14 EP 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-20090042878-A1 THIENOPYRIMIDYLAMINES AS MODULATORS OF THE EP2 RECEPTOR PTGER2, PTGER1, PTGDR2 TYK2 1012/4885NPC1 3333/4885RAB9A 3562/4885

“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.