SCHEMBL3636076

SCHEMBL3636076

Cc1[nH]c2c(F)cccc2c1CC(N)=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.55
GAA P10253 2/20 0.55
MAPT P10636 2/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
ANO1 Q5XXA6 1/20 0.52
MPO P05164 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 2/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
FEN1 P39748 1/20 0.40
NTRK1 P04629 1/20 0.40
THRB P10828 1/20 0.39
HPGD P15428 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
EIF2AK3 Q9NZJ5 1/20 0.38
EGFR P00533 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL4470156 0.87 KDM4E (0.73) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL3264986 0.85 MAPT (0.75) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL3383227 0.82 MAPT (0.55) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL3261669 0.82 KDM4E (0.44) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL3382868 0.82 KDM4E (0.55) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL3382448 0.82 SMN1; SMN2 (0.64) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL20119993 0.81 EGFR (0.54) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL3263047 0.81 MAPT (0.39) KDM4EGAAMAPTMEN1KMT2A
Oxalic Acid SCHEMBL31535593 0.80 SMN1; SMN2 (0.58) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL3638375 0.79 CYP1A2 (0.45) KDM4EGAAMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2167077-A2 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR Bayer Schering Pharma Aktiengesellschaft (DE) 2010-03-31 EP claimed
US-20090023741-A1 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AG (DE) 2009-01-22 US claimed
WO-2008152099-A2 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-18 WO claimed
EP-2167077-A2 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR Bayer Schering Pharma Aktiengesellschaft (DE) 2010-03-31 EP disclosed
US-20090023741-A1 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AG (DE) 2009-01-22 US disclosed
WO-2008152099-A2 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-18 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-20090023741-A1 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR PTGER2, PTGER1, PTGDR2 KDM4E 3048/4885GAA 3039/4885MAPT 4842/4885

“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.