SCHEMBL4137386

SCHEMBL4137386

CC(=O)NCc1cccc(-c2ccc(C(=O)O)cc2)c1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.66
KMT2A Q03164 1/20 0.64
NR1H4 Q96RI1 3/20 0.58
EPHX2 P34913 2/20 0.58
AOC3 Q16853 4/20 0.55
HDAC1 Q13547 1/20 0.54
LIPG Q9Y5X9 1/20 0.52
FNTA P49354 1/20 0.51
FNTB P49356 1/20 0.51
RXRA P19793 4/20 0.50
RXRB P28702 4/20 0.50
RXRG P48443 1/20 0.50
EGFR P00533 1/20 0.49

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
SCHEMBL6418674 0.89 AOC3 (0.67) KMT2ANR1H4EPHX2AOC3HDAC1
SCHEMBL5724620 0.85 LIPG (0.60) KMT2AAOC3HDAC1LIPGEGFR
SCHEMBL25542634 0.84 LIPG (0.56) BCL2AOC3HDAC1LIPG
SCHEMBL5445345 0.83 LMNA (0.68) BCL2KMT2ANR1H4EPHX2AOC3
SCHEMBL3530258 0.83 KMT2A (0.64) KMT2ANR1H4HDAC1
SCHEMBL5549803 0.81 HDAC1 (0.60) BCL2NR1H4EPHX2AOC3HDAC1
SCHEMBL23442907 0.81 LIPG (0.54) BCL2AOC3HDAC1LIPG
SCHEMBL3145591 0.81 AOC3 (0.52) KMT2AAOC3HDAC1LIPG
SCHEMBL5944011 0.80 HDAC1 (0.61) BCL2NR1H4EPHX2AOC3HDAC1
SCHEMBL12894973 0.80 BCL2 (1.00) BCL2NR1H4EPHX2AOC3RXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090023741-A1 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AG (DE) 2009-01-22 US claimed
US-20090023741-A1 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AG (DE) 2009-01-22 US 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 BCL2 2466/4885KMT2A 1480/4885NR1H4 44/4885

“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.