Setipiprant

Setipiprant

SCHEMBL3089969

O=C(O)Cn1c2c(c3cc(F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PTGDR2

The experimentally established mechanism targets of Setipiprant. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGDR2 known ✓ Q9Y5Y4 19/20 1.00
PTGDR Q13258 6/20 1.00
PTGER2 P43116 5/20 1.00
CYP2C9 P11712 4/20 0.80

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
Setipiprant SCHEMBL29358337 1.00 PTGDR2 (1.00) PTGDR2PTGDRPTGER2CYP2C9
Setipiprant SCHEMBL29355657 1.00 PTGDR2 (1.00) PTGDR2PTGDRPTGER2CYP2C9
SCHEMBL3089983 0.89 PTGDR2 (1.00) PTGDR2PTGDRPTGER2CYP2C9
SCHEMBL3083833 0.89 PTGDR2 (1.00) PTGDR2PTGDRPTGER2CYP2C9
SCHEMBL3083273 0.89 PTGDR2 (0.80) PTGDR2PTGDRPTGER2CYP2C9
SCHEMBL3091135 0.89 PTGDR2 (1.00) PTGDR2PTGDRPTGER2CYP2C9
SCHEMBL3081699 0.86 PTGDR2 (1.00) PTGDR2PTGDRPTGER2CYP2C9
SCHEMBL3079230 0.85 PTGDR2 (1.00) PTGDR2PTGDRPTGER2CYP2C9
SCHEMBL3085508 0.85 PTGDR2 (0.73) PTGDR2PTGDRPTGER2CYP2C9
SCHEMBL3083537 0.84 PTGDR2 (0.73) PTGDR2PTGDRPTGER2CYP2C9

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3941579-A1 POSTURAL ORTHOSTATIC TACHYCARDIA SYNDROME AND CRTH2 Amerimmune, LLC (US) 2022-01-26 EP claimed
WO-2020190905-A1 POSTURAL ORTHOSTATIC TACHYCARDIA SYNDROME AND CRTH2 AMERIMMUNE, LLC (US) 2020-09-24 WO claimed
US-20100234396-A1 Tetrhydropyridoindole Derivatives ACTELION PHARMACEUTICALS LTD (CH) 2010-09-16 US claimed
US-7714132-B2 Tetrahydropyridoindole derivatives ACTELION PHARMACEUTICALS, LTD. (CH) 2010-05-11 US claimed
EP-1725553-B1 TETRAHYDROPYRIDOINDOLE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2008-05-07 EP claimed
US-20070191416-A1 Tetrahydropyridoindole derivatives IDORSIA PHARMACEUTICALS LTD (CH) 2007-08-16 US claimed
EP-1725553-A1 TETRAHYDROPYRIDOINDOLE DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2006-11-29 EP claimed
WO-2005095397-A1 TETRAHYDROPYRIDOINDOLE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2005-10-13 WO claimed
US-20230330062-A1 PTGDR-1 AND/OR PTGDR-2 ANTAGONISTS FOR PREVENTING AND/OR TREATING SYSTEMIC LUPUS ERYTHEMATOSUS INST NAT SANTE RECH MED (FR) 2023-10-19 US disclosed
US-20230330062-A1 PTGDR-1 AND/OR PTGDR-2 ANTAGONISTS FOR PREVENTING AND/OR TREATING SYSTEMIC LUPUS ERYTHEMATOSUS INST NAT SANTE RECH MED (FR) 2023-10-19 US disclosed
US-11559513-B2 PTGDR-1 and/or PTGDR-2 antagonists for preventing and/or treating systemic lupus erythematosus INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2023-01-24 US disclosed
EP-3941579-A1 POSTURAL ORTHOSTATIC TACHYCARDIA SYNDROME AND CRTH2 Amerimmune, LLC (US) 2022-01-26 EP disclosed
WO-2020190905-A1 POSTURAL ORTHOSTATIC TACHYCARDIA SYNDROME AND CRTH2 AMERIMMUNE, LLC (US) 2020-09-24 WO disclosed
US-20200261413-A1 PTGDR-1 AND/OR PTGDR-2 ANTAGONISTS FOR PREVENTING AND/OR TREATING SYSTEMIC LUPUS ERYTHEMATOSUS UNIVERSITÉ PARIS CITÉ (FR) 2020-08-20 US disclosed
US-20100234396-A1 Tetrhydropyridoindole Derivatives ACTELION PHARMACEUTICALS LTD (CH) 2010-09-16 US disclosed
US-7714132-B2 Tetrahydropyridoindole derivatives ACTELION PHARMACEUTICALS, LTD. (CH) 2010-05-11 US disclosed
EP-1725553-B1 TETRAHYDROPYRIDOINDOLE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2008-05-07 EP disclosed
US-20070191416-A1 Tetrahydropyridoindole derivatives IDORSIA PHARMACEUTICALS LTD (CH) 2007-08-16 US disclosed
EP-1725553-A1 TETRAHYDROPYRIDOINDOLE DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2006-11-29 EP disclosed
WO-2005095397-A1 TETRAHYDROPYRIDOINDOLE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2005-10-13 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 (5 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-20100234396-A1 Tetrhydropyridoindole Derivatives TPH2, TPH1, HTR5A PTGDR2 170/4885PTGDR 135/4885PTGER2 351/4885
US-20230330062-A1 PTGDR-1 AND/OR PTGDR-2 ANTAGONISTS FOR PREVENTING AND/OR TREATING SYSTEMIC LUPUS ERYTHEMATOSUS PTGDR2, PTGDR, PTGIR PTGDR2 1/4885PTGDR 2/4885PTGER2 9/4885
US-20070191416-A1 Tetrahydropyridoindole derivatives TPH2, TPH1, HTR2C PTGDR2 154/4885PTGDR 119/4885PTGER2 213/4885
US-20200261413-A1 PTGDR-1 AND/OR PTGDR-2 ANTAGONISTS FOR PREVENTING AND/OR TREATING SYSTEMIC LUPUS ERYTHEMATOSUS PTGDR, PTGDR2, PTGIR PTGDR2 2/4885PTGDR 1/4885PTGER2 9/4885
US-11559513-B2 PTGDR-1 and/or PTGDR-2 antagonists for preventing and/or treating systemic lupus erythematosus PTGDR, PTGDR2, PTGIR PTGDR2 2/4885PTGDR 1/4885PTGER2 9/4885

“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.