SCHEMBL136936

SCHEMBL136936

COC(=O)Cc1ccc(OC)c(-c2ccc(C)cc2CN(C(C)=O)C2CC2)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 15/20 0.49
CETP P11597 2/20 0.43
PTGDR Q13258 3/20 0.42
TBXA2R P21731 2/20 0.42
ABL1 P00519 1/20 0.40
RIN1 Q13671 1/20 0.40
JAK2 O60674 1/20 0.38
JAK3 P52333 1/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL134779 0.97 PTGDR2 (0.50) PTGDR2CETPPTGDRTBXA2RABL1
SCHEMBL134783 0.96 PTGDR2 (0.51) PTGDR2CETPPTGDRTBXA2RABL1
SCHEMBL136794 0.91 PTGDR2 (0.59) PTGDR2PTGDRTBXA2RCYP3A4
SCHEMBL137271 0.90 PTGDR2 (0.44) PTGDR2CETPPTGDRTBXA2RABL1
SCHEMBL137585 0.88 PTGDR2 (0.59) PTGDR2PTGDRTBXA2RCYP3A4
SCHEMBL151689 0.87 PTGDR2 (0.65) PTGDR2CETPPTGDRTBXA2RCYP3A4
SCHEMBL137591 0.87 PTGDR2 (0.60) PTGDR2PTGDRTBXA2RCYP3A4
SCHEMBL134786 0.85 PTGDR2 (0.70) PTGDR2PTGDRTBXA2RCYP3A4
SCHEMBL152338 0.85 PTGDR2 (0.65) PTGDR2CETPPTGDRTBXA2RCYP3A4
SCHEMBL137362 0.84 PTGDR2 (0.45) PTGDR2CETPPTGDRTBXA2RABL1

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 PTGDR2 2/4885CETP 3676/4885PTGDR 1/4885
US-20110039852-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 PTGDR2 2/4885CETP 3676/4885PTGDR 1/4885
US-20120058123-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 PTGDR2 2/4885CETP 3676/4885PTGDR 1/4885

“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.