SCHEMBL1059280

SCHEMBL1059280

CC(=O)NCc1cc(C(F)(F)F)ccc1-c1cc(CC(=O)O)ccc1C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 18/20 0.56
PSEN1 P49768 1/20 0.51
PSEN2 P49810 1/20 0.51
APH1B Q8WW43 1/20 0.51
NCSTN Q92542 1/20 0.51
APH1A Q96BI3 1/20 0.51
PSENEN Q9NZ42 1/20 0.51
TBXA2R P21731 5/20 0.50
PTGDR Q13258 5/20 0.50
CYP3A4 P08684 2/20 0.44
CYP2C9 P11712 2/20 0.44
PTGIR P43119 2/20 0.44
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 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
SCHEMBL1054098 0.89 PTGDR2 (0.56) PTGDR2PSEN1PSEN2APH1BNCSTN
SCHEMBL1055326 0.86 PTGDR2 (0.75) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL15134863 0.84 PTGDR2 (0.52) PTGDR2PSEN1PSEN2APH1BNCSTN
SCHEMBL139547 0.81 PTGDR2 (0.63) PTGDR2PSEN1PSEN2APH1BNCSTN
SCHEMBL1057389 0.78 PTGDR2 (0.81) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL1055322 0.77 PTGDR2 (0.73) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL3627264 0.77 PTGDR2 (0.73) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL3629694 0.76 PTGDR2 (0.69) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL1060068 0.76 RXRA (0.46) PTGDR2PSEN1PSEN2APH1BNCSTN
SCHEMBL1060296 0.75 PTGDR2 (0.71) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9

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-8497381-B2 Antagonists of prostaglandin D2 receptors PANMIRA PHARMACEUTICALS, LLC (US) 2013-07-30 US disclosed
US-20110021573-A1 ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2011-01-27 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-20110021573-A1 ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 PTGDR2 2/4885PSEN1 3725/4885PSEN2 2181/4885

“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.