SCHEMBL134673

SCHEMBL134673

CCN(Cc1cc(C)ccc1-c1cc(C(C)C(=O)O)ccc1OC)C(C)=O

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 6/20 0.47
AKR1C2 P52895 6/20 0.47
CETP P11597 10/20 0.44
PTGDR2 Q9Y5Y4 4/20 0.41
TBXA2R P21731 1/20 0.41
PTGDR Q13258 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
SCHEMBL135807 0.91 CETP (0.42) CETPPTGDR2TBXA2RPTGDR
SCHEMBL134884 0.87 PTGDR2 (0.54) AKR1C3AKR1C2CETPPTGDR2PTGDR
SCHEMBL134883 0.87 PTGDR2 (0.54) AKR1C3AKR1C2CETPPTGDR2PTGDR
SCHEMBL134893 0.87 PTGDR2 (0.54) AKR1C3AKR1C2CETPPTGDR2PTGDR
SCHEMBL153972 0.86 CETP (0.61) AKR1C3AKR1C2CETPPTGDR2TBXA2R
SCHEMBL134900 0.85 AKR1C3 (0.41) AKR1C3AKR1C2CETPPTGDR2TBXA2R
SCHEMBL136018 0.85 PTGDR2 (0.60) AKR1C3AKR1C2CETPPTGDR2TBXA2R
SCHEMBL137111 0.84 PTGDR2 (0.57) AKR1C3AKR1C2CETPPTGDR2TBXA2R
SCHEMBL136262 0.81 PTGDR2 (0.62) PTGDR2TBXA2RPTGDR
SCHEMBL136996 0.79 CETP (0.48) CETPPTGDR2TBXA2RPTGDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130158036-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PANMIRA PHARMACEUTICALS, LLC (US) 2013-06-20 US disclosed
US-8362044-B2 N,N-disubstituted aminoalkylbiphenyl antagonists of prostaglandin D2 receptors PANMIRA PHARMACEUTICALS, LLC (US) 2013-01-29 US disclosed
US-20120058123-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PANMIRA PHARMACEUTICALS, LLC. (US) 2012-03-08 US disclosed
US-20110039852-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2011-02-17 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 (3 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-20130158036-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 AKR1C3 1005/4885AKR1C2 1034/4885CETP 3676/4885
US-20110039852-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 AKR1C3 1005/4885AKR1C2 1034/4885CETP 3676/4885
US-20120058123-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 AKR1C3 1005/4885AKR1C2 1034/4885CETP 3676/4885

“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.