SCHEMBL1644083

SCHEMBL1644083

C[C@@H](NC(=O)OCc1ccccc1)C(=O)Oc1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.55
TAAR1 Q96RJ0 1/20 0.53
MEN1 O00255 1/20 0.52
LMNA P02545 1/20 0.52
KMT2A Q03164 1/20 0.52
CTSK P43235 5/20 0.52
CTSL P07711 1/20 0.51
CTSB P07858 1/20 0.51
CTSS P25774 1/20 0.51
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
HPGD P15428 1/20 0.51
HTT P42858 1/20 0.51
PPARA Q07869 2/20 0.50
CCR1 P32246 2/20 0.50
ATM Q13315 2/20 0.50
ELANE P08246 1/20 0.50

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
SCHEMBL1286216 0.91 ELANE (0.59) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL10425602 0.88 ATM (0.62) TAAR1MEN1LMNAKMT2ACTSK
SCHEMBL10589262 0.85 CTSK (0.49) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL10589260 0.85 CTSK (0.49) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL1801469 0.84 HTR2A (0.56) TP53MEN1KMT2ACTSKCTSL
SCHEMBL10794620 0.84 HTR2A (0.56) TP53MEN1KMT2ACTSKCTSL
SCHEMBL7215150 0.84 TACR1 (0.56) TP53MEN1LMNAKMT2ACTSK
SCHEMBL7221789 0.84 TACR1 (0.56) TP53MEN1LMNAKMT2ACTSK
SCHEMBL3487855 0.83 TP53 (0.53) TP53MEN1LMNAKMT2ACTSK
SCHEMBL3483760 0.83 TP53 (0.53) 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 2 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

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 4513/4885TAAR1 349/4885MEN1 4770/4885

“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.