SCHEMBL3483760

SCHEMBL3483760

C[C@@H](NC(=O)OCc1ccccc1)C(=O)c1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.53
MEN1 O00255 1/20 0.53
LMNA P02545 1/20 0.53
KMT2A Q03164 1/20 0.53
CTSK P43235 5/20 0.53
CTSL P07711 1/20 0.52
CTSB P07858 1/20 0.52
CTSS P25774 1/20 0.52
ATM Q13315 1/20 0.51
PPARA Q07869 2/20 0.51
CCR1 P32246 2/20 0.51
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
ELANE P08246 1/20 0.48
CTRB1 P17538 2/20 0.48

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
SCHEMBL1644719 1.00 TP53 (0.53) TP53MEN1LMNAKMT2ACTSK
SCHEMBL3487855 1.00 TP53 (0.53) TP53MEN1LMNAKMT2ACTSK
SCHEMBL5898129 0.86 CTSK (0.59) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL5898328 0.86 ATM (0.60) TP53MEN1LMNAKMT2ACTSK
SCHEMBL5325045 0.86 CTSK (0.59) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL5325046 0.86 CTSK (0.59) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL4870019 0.85 CTSK (0.50) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL27752931 0.84 POLB (0.57) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL16695336 0.83 PPARA (0.56) TP53MEN1KMT2ACTSKCTSL
SCHEMBL1644083 0.83 TP53 (0.55) TP53MEN1LMNAKMT2ACTSK

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-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
EP-2257536-A2 CYCLIC DIARYL ETHER AS ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS Amira Pharmaceuticals, Inc. (US) 2010-12-08 EP disclosed
WO-2009102893-A2 CYCLIC DIARYL ETHER COMPOUNDS AS ANTAGONISTS OF PROSTAGLANDIN D2 receptors AMIRA PHARMACEUTICALS, INC. (US) 2009-08-20 WO 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 TP53 4513/4885MEN1 4770/4885LMNA 2386/4885

“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.