SCHEMBL4069817

SCHEMBL4069817

Cc1[nH]c2c(C)cccc2c1CCNc1ncnc2cc(-c3cccc(NS(C)(=O)=O)c3)sc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 15/20 0.46
CYP3A4 P08684 14/20 0.46
CLK4 Q9HAZ1 11/20 0.46
LMNA P02545 7/20 0.46
ALDH1A1 P00352 6/20 0.46
USP2 O75604 12/20 0.45
HIF1A Q16665 6/20 0.45
TSHR P16473 5/20 0.45
CYP2C19 P33261 10/20 0.44
CYP2D6 P10635 9/20 0.44
MAPK1 P28482 6/20 0.44
CYP2C9 P11712 5/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
HPGD P15428 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 3/20 0.43
KDM4E B2RXH2 2/20 0.43
RAF1 P04049 2/20 0.43
GSK3B P49841 1/20 0.41

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
SCHEMBL3939158 0.88 FLT1 (0.48) LMNAALDH1A1MAPK1MEN1KMT2A
SCHEMBL3929417 0.88 STK17B (0.51) CYP1A2CYP3A4CLK4ALDH1A1USP2
SCHEMBL4076235 0.87 MAP3K8 (0.43) CLK4ALDH1A1MEN1KMT2AMAPT
SCHEMBL3928997 0.86 CYP1A2 (0.42) CYP1A2CYP3A4CLK4LMNAALDH1A1
SCHEMBL3931001 0.84 IKBKB (0.42) LMNAALDH1A1KDM4EFLT1EGFR
SCHEMBL4068884 0.84 TYK2 (0.53) CYP1A2CYP3A4CLK4ALDH1A1TSHR
SCHEMBL4007903 0.82 STK17B (0.42) CYP1A2CYP3A4CLK4LMNAALDH1A1
SCHEMBL4008652 0.81 CDK1 (0.41) CYP1A2CYP3A4CLK4ALDH1A1USP2
SCHEMBL4076692 0.80 CYP1A2 (0.55) CYP1A2CYP3A4CLK4LMNAALDH1A1
SCHEMBL13960063 0.80 NPC1 (0.44) CYP1A2CYP3A4CLK4ALDH1A1USP2

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-20090042913-A1 Indolylalkylthienopyrimidylamines as modulators of the EP2 receptor BAYER SCHERING PHARMA AG (DE) 2009-02-12 US claimed
EP-2014662-A1 Indolyl alkyl thieno-pyrimidyl amines as modulators of EP2 receptors Bayer Schering Pharma Aktiengesellschaft (DE) 2009-01-14 EP claimed
US-20090042913-A1 Indolylalkylthienopyrimidylamines as modulators of the EP2 receptor BAYER SCHERING PHARMA AG (DE) 2009-02-12 US disclosed
US-20090042913-A1 Indolylalkylthienopyrimidylamines as modulators of the EP2 receptor BAYER SCHERING PHARMA AG (DE) 2009-02-12 US disclosed
EP-2014662-A1 Indolyl alkyl thieno-pyrimidyl amines as modulators of EP2 receptors Bayer Schering Pharma Aktiengesellschaft (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-20090042913-A1 Indolylalkylthienopyrimidylamines as modulators of the EP2 receptor PTGER2, PTGER1, PTGDR2 CYP1A2 403/4885CYP3A4 1400/4885CLK4 4381/4885

“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.