Orvepitant

Orvepitant

SCHEMBL2179896

Cc1cc(F)ccc1[C@H]1C[C@H](N2CCN3C(=O)CC[C@H]3C2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

TACR1

The experimentally established mechanism targets of Orvepitant. 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
TACR1 known ✓ P25103 19/20 1.00
SIGMAR1 Q99720 2/20 1.00
PTAFR P25105 1/20 1.00
CYP3A4 P08684 2/20 0.74

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
Orvepitant SCHEMBL21931158 1.00 TACR1 (1.00) TACR1SIGMAR1PTAFRCYP3A4
Orvepitant SCHEMBL2483270 1.00 TACR1 (1.00) TACR1SIGMAR1PTAFRCYP3A4
Orvepitant SCHEMBL1421784 1.00 TACR1 (1.00) TACR1SIGMAR1PTAFRCYP3A4
Orvepitant SCHEMBL29373789 1.00 TACR1 (1.00) TACR1SIGMAR1PTAFRCYP3A4
Orvepitant SCHEMBL2484579 1.00 TACR1 (1.00) TACR1SIGMAR1PTAFRCYP3A4
Orvepitant SCHEMBL19581227 1.00 TACR1 (1.00) TACR1SIGMAR1PTAFRCYP3A4
Orvepitant SCHEMBL23895405 1.00 TACR1 (1.00) TACR1SIGMAR1PTAFRCYP3A4
Orvepitant SCHEMBL19117640 1.00 TACR1 (1.00) TACR1SIGMAR1PTAFRCYP3A4
Orvepitant SCHEMBL5360752 0.99 TACR1 (0.99) TACR1SIGMAR1PTAFRCYP3A4
Orvepitant SCHEMBL30110395 0.99 TACR1 (0.99) TACR1SIGMAR1PTAFRCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2297152-B1 ANHYDROUS CRYSTAL FORM OF ORVEPITANT MALEATE NERRE THERAPEUTICS LTD (GB) 2014-11-12 EP disclosed
US-8309553-B2 Anhydrous crystal form of ovrepitant maleate GLAXO GROUP LIMITED (GB) 2012-11-13 US disclosed
EP-2117535-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING NK1 RECEPTOR ANTAGONISTS AND SODIUM CHANNEL BLOCKERS GLAXO GROUP LTD (GB) 2011-10-26 EP disclosed
EP-2117562-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING NK1 RECEPTOR ANTAGONISTS AND SODIUM CHANNEL BLOCKERS GLAXO GROUP LTD (GB) 2011-10-26 EP disclosed
US-20110166150-A1 Anhydrous Crystal Form Of Ovrepitant Maleate GLAXO GROUP LIMITED 2011-07-07 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-20110166150-A1 Anhydrous Crystal Form Of Ovrepitant Maleate OR10J3, AVPR2, AVPR1A TACR1 40/4885SIGMAR1 75/4885PTAFR 806/4885

“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.