SCHEMBL14733237

SCHEMBL14733237

CCCOC(=O)Cc1ccc(OC)c(Oc2ccc(NC(=O)C(C)(C)C)cc2CSC(C)(C)C)c1

nearest known ligand 0.77

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.77
L3MBTL1 Q9Y468 1/20 0.44
ALDH1A1 P00352 2/20 0.40
PTGDR2 Q9Y5Y4 6/20 0.40
PPARG P37231 2/20 0.38
PPARA Q07869 2/20 0.38
EPHX2 P34913 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
LMNA P02545 2/20 0.37
HTT P42858 2/20 0.37
KMT2A Q03164 2/20 0.37
GNRHR P30968 1/20 0.36
STAT3 P40763 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL349965 0.93 CYP3A4 (0.80) CYP3A4L3MBTL1ALDH1A1PTGDR2EPHX2
SCHEMBL19033463 0.92 CYP3A4 (0.76) CYP3A4L3MBTL1ALDH1A1PTGDR2PPARG
SCHEMBL14733238 0.91 CYP3A4 (0.75) CYP3A4L3MBTL1PTGDR2PPARGPPARA
SCHEMBL2361747 0.91 CYP3A4 (0.85) CYP3A4L3MBTL1ALDH1A1PTGDR2EPHX2
SCHEMBL14733229 0.87 CYP3A4 (0.85) CYP3A4L3MBTL1PTGDR2EPHX2SMN1; SMN2
Am-461 SCHEMBL29567409 0.87 CYP3A4 (1.00) CYP3A4L3MBTL1ALDH1A1PTGDR2EPHX2
Am-461 SCHEMBL349848 0.87 CYP3A4 (1.00) CYP3A4L3MBTL1ALDH1A1PTGDR2EPHX2
Am-461 SCHEMBL14715970 0.86 CYP3A4 (0.84) CYP3A4L3MBTL1PTGDR2EPHX2SMN1; SMN2
Am-461 SCHEMBL14715969 0.86 CYP3A4 (0.98) CYP3A4L3MBTL1ALDH1A1PTGDR2EPHX2
Am-461 SCHEMBL14715972 0.86 CYP3A4 (0.98) CYP3A4L3MBTL1ALDH1A1PTGDR2EPHX2

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-9688624-B2 DP2 antagonist and uses thereof BRICKELL BIOTECH, INC. (US) 2017-06-27 US disclosed
US-20130053444-A1 DP2 ANTAGONIST AND USES THEREOF PANMIRA PHARMACEUTICALS, LLC (US) 2013-02-28 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-20130053444-A1 DP2 ANTAGONIST AND USES THEREOF PTGER2, PTGDR2, PTGES2 CYP3A4 2497/4885L3MBTL1 2926/4885ALDH1A1 739/4885

“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.