SCHEMBL1643019

SCHEMBL1643019

COC(=O)Cc1ccc(OC)c(Oc2ccc(C(F)(F)F)cc2CO)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PTGDR2 Q9Y5Y4 8/20 0.46
TBXA2R P21731 2/20 0.46
PTGDR Q13258 2/20 0.46
KMT2A Q03164 1/20 0.44
FFAR1 O14842 1/20 0.43
FFAR2 O15552 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CETP P11597 1/20 0.42
SCN8A Q9UQD0 1/20 0.42
SCN10A Q9Y5Y9 1/20 0.42
CYP3A4 P08684 1/20 0.42
PPARA Q07869 1/20 0.41

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
SCHEMBL1643088 0.90 PTGDR2 (0.44) LMNASMN1; SMN2PTGDR2TBXA2RPTGDR
SCHEMBL13760999 0.90 PTGDR2 (0.46) LMNASMN1; SMN2PTGDR2TBXA2RPTGDR
SCHEMBL1644488 0.90 PTGDR2 (0.46) LMNASMN1; SMN2PTGDR2TBXA2RPTGDR
SCHEMBL148769 0.84 PTGDR2 (0.61) PTGDR2TBXA2RPTGDRCETPCYP3A4
SCHEMBL1643183 0.83 KDM4E (0.44) LMNASMN1; SMN2PTGDR2TBXA2RPTGDR
SCHEMBL1643585 0.82 MEN1 (0.47) LMNASMN1; SMN2PTGDR2KMT2AKDM4E
SCHEMBL13761111 0.81 PTGDR2 (0.43) LMNASMN1; SMN2PTGDR2TBXA2RPTGDR
SCHEMBL1644127 0.81 DRD2 (0.45) PTGDR2TBXA2RPTGDRFFAR1FFAR2
SCHEMBL1945418 0.80 PTGDR2 (0.47) LMNASMN1; SMN2PTGDR2TBXA2RPTGDR
SCHEMBL1643054 0.80 PTGDR2 (0.41) LMNASMN1; SMN2PTGDR2TBXA2RPTGDR

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 LMNA 2386/4885SMN1; SMN2 4772/4885PTGDR2 2/4885

“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.