SCHEMBL3930205

SCHEMBL3930205

COc1cccc(-c2cc3ncnc(N(C)c4ccc5c(c4)OCO5)c3s2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 6/20 0.45
ALDH1A1 P00352 3/20 0.43
LMNA P02545 3/20 0.43
CYP1A2 P05177 3/20 0.43
CYP3A4 P08684 3/20 0.43
CYP2D6 P10635 3/20 0.43
TSHR P16473 3/20 0.43
MAPK1 P28482 3/20 0.43
CYP2C19 P33261 3/20 0.43
HIF1A Q16665 2/20 0.43
USP2 O75604 2/20 0.43
GLA P06280 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MAPT P10636 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL4064459 0.91 KMT2A (0.52) CLK4ALDH1A1LMNACYP1A2CYP3A4
SCHEMBL4071264 0.88 CLK4 (0.39) CLK4ALDH1A1LMNACYP1A2CYP3A4
SCHEMBL4074719 0.87 EGFR (0.46) CLK4ALDH1A1LMNACYP1A2CYP3A4
SCHEMBL4075049 0.87 MAP3K8 (0.45) CLK4ALDH1A1LMNACYP1A2CYP3A4
SCHEMBL4069658 0.87 EGFR (0.47) CLK4ALDH1A1LMNACYP1A2CYP3A4
SCHEMBL4068214 0.87 CLK4 (0.42) CLK4ALDH1A1LMNACYP1A2CYP3A4
SCHEMBL3933682 0.87 STK17B (0.44) CLK4ALDH1A1LMNACYP1A2CYP3A4
SCHEMBL3938276 0.85 CLK4 (0.51) CLK4ALDH1A1LMNACYP1A2CYP3A4
SCHEMBL4074807 0.85 STK17B (0.48) CLK4ALDH1A1LMNACYP1A2CYP3A4
SCHEMBL4076018 0.85 EGFR (0.43) CLK4ALDH1A1LMNACYP1A2CYP3A4

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
US-20090042878-A1 THIENOPYRIMIDYLAMINES AS MODULATORS OF THE EP2 RECEPTOR BAYER SHERING PHARMA AG (DE) 2009-02-12 US claimed
WO-2009007422-A1 THIENOPYRIMIDYLAMINES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-01-15 WO 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
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 CLK4 4484/4885ALDH1A1 1167/4885LMNA 3392/4885

“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.