SCHEMBL5881179

SCHEMBL5881179

CC[C@H](C)[C@@H](C(=O)N[C@]1(C(=O)N[C@H](C(N)=O)C(C)C)CCc2[nH]c3ccccc3c2C1)N(Cc1ccccc1)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NMBR P28336 13/20 0.41
TACR1 P25103 1/20 0.39
OPRD1 P41143 1/20 0.35

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
SCHEMBL5881011 0.97 NMBR (0.41) NMBRTACR1
SCHEMBL5881289 0.92 NMBR (0.41) NMBRTACR1OPRD1
SCHEMBL5881170 0.92 NMBR (0.40) NMBRTACR1
SCHEMBL5881195 0.91 NMBR (0.36) NMBRTACR1OPRD1
SCHEMBL5881051 0.91 NMBR (0.37) NMBRTACR1OPRD1
SCHEMBL5881213 0.90 NMBR (0.40) NMBRTACR1
SCHEMBL5881058 0.90 NMBR (0.40) NMBRTACR1
SCHEMBL5881161 0.90 NMBR (0.42) NMBRTACR1OPRD1
SCHEMBL5881090 0.89 NMBR (0.38) NMBRTACR1OPRD1
SCHEMBL5881185 0.87 OPRD1 (0.34) NMBRTACR1OPRD1

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-7122570-B2 Tetrahydrocarbazol derivatives as ligands for G-protein-coupled receptors (GPCR) ZENTARIS AG (DE) 2006-10-17 US claimed
US-20030232873-A1 Tetrahydrocarbazol derivatives as ligands for G-protein-coupled receptors (GPCR) ZENTARIS AG (DE) 2003-12-18 US claimed

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-20030232873-A1 Tetrahydrocarbazol derivatives as ligands for G-protein-coupled receptors (GPCR) GPR4, GPR88, GPR35 NMBR 287/4885TACR1 300/4885OPRD1 510/4885

“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.