SCHEMBL1644812

SCHEMBL1644812

CCOC(=O)Cc1ccc(OC)c(Oc2ccc(NC(=O)NCc3ccccc3)cc2CN2CCOC2=O)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
L3MBTL1 Q9Y468 2/20 0.41
TSHR P16473 1/20 0.40
ALDH1A1 P00352 1/20 0.40
NAMPT P43490 1/20 0.40
GSK3B P49841 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 2/20 0.38
CYP3A4 P08684 1/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.37
HTT P42858 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
SCHEMBL1643727 0.92 CYP3A4 (0.46) MAPTL3MBTL1TSHRALDH1A1GSK3B
SCHEMBL1643253 0.90 L3MBTL1 (0.46) MAPTL3MBTL1TSHRALDH1A1PTGDR2
SCHEMBL13761020 0.89 L3MBTL1 (0.41) MAPTL3MBTL1PTGDR2KMT2ACYP3A4
SCHEMBL1643912 0.86 L3MBTL1 (0.44) MAPTL3MBTL1ALDH1A1PTGDR2KMT2A
SCHEMBL1643160 0.86 L3MBTL1 (0.47) MAPTL3MBTL1ALDH1A1POLBKMT2A
SCHEMBL1644798 0.86 CYP3A4 (0.51) MAPTL3MBTL1ALDH1A1PTGDR2KMT2A
SCHEMBL1643702 0.86 L3MBTL1 (0.51) MAPTL3MBTL1ALDH1A1PTGDR2KMT2A
SCHEMBL1643245 0.84 FAAH (0.41) L3MBTL1ALDH1A1KMT2ACYP3A4LMNA
SCHEMBL1643754 0.83 SSTR1 (0.42) L3MBTL1ALDH1A1TP53POLBKMT2A
SCHEMBL1643664 0.83 CPT1A (0.44) MAPTL3MBTL1TSHRALDH1A1PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242145-B2 Cyclic diaryl ether compounds as antagonists of prostaglandin D2 receptors PANMIRA PHARMACEUTICALS, LLC (US) 2012-08-14 US disclosed
US-8242145-B2 Cyclic diaryl ether compounds as antagonists of prostaglandin D2 receptors PANMIRA PHARMACEUTICALS, LLC (US) 2012-08-14 US disclosed
US-8242145-B2 Cyclic diaryl ether compounds as antagonists of prostaglandin D2 receptors PANMIRA PHARMACEUTICALS, LLC (US) 2012-08-14 US disclosed
US-20110098302-A1 CYCLIC DIARYL ETHER COMPOUNDS AS ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2011-04-28 US disclosed
US-20110098302-A1 CYCLIC DIARYL ETHER COMPOUNDS AS ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2011-04-28 US disclosed
US-20110098302-A1 CYCLIC DIARYL ETHER COMPOUNDS AS ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2011-04-28 US disclosed
WO-2009102893-A2 CYCLIC DIARYL ETHER COMPOUNDS AS ANTAGONISTS OF PROSTAGLANDIN D2 receptors AMIRA PHARMACEUTICALS, INC. (US) 2009-08-20 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-20110098302-A1 CYCLIC DIARYL ETHER COMPOUNDS AS ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER1 MAPT 4875/4885L3MBTL1 4114/4885TSHR 819/4885

“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.