SCHEMBL10242214

SCHEMBL10242214

CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2C[C@H](C)CNC(=O)[C@H](CN(C)C)NC1=O

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MLNR O43193 19/20 0.69
GHSR Q92847 1/20 0.52

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
SCHEMBL765432 0.92 MLNR (0.82) MLNRGHSR
SCHEMBL10150923 0.91 MLNR (0.68) MLNRGHSR
SCHEMBL11982923 0.91 MLNR (0.68) MLNRGHSR
SCHEMBL13392344 0.90 MLNR (0.84) MLNR
SCHEMBL14037154 0.90 MLNR (0.69) MLNRGHSR
SCHEMBL17081904 0.88 MLNR (0.67) MLNRGHSR
SCHEMBL11982875 0.87 MLNR (0.69) MLNR
SCHEMBL11982921 0.87 MLNR (0.69) MLNR
SCHEMBL13392244 0.82 MLNR (0.88) MLNR
SCHEMBL10150187 0.82 MLNR (1.00) MLNR

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-9029501-B2 Method for making macrocycles RIGEL PHARMACEUTICALS, INC. (US) 2015-05-12 US disclosed
US-20130217874-A1 METHOD FOR MAKING MACROCYCLES RIGEL PHARMACEUTICALS, INC. (US) 2013-08-22 US disclosed
WO-2012061408-A2 METHOD FOR MAKING MACROCYCLES RIGEL PHARMACEUTICALS. INC. (US) 2012-05-10 WO disclosed
US-7452862-B2 Conformationally-controlled biologically active macrocyclic small molecules as motilin antagonists or ghrelin agonists TRANZYME PHARMA, INC. (CA) 2008-11-18 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-20130217874-A1 METHOD FOR MAKING MACROCYCLES EZR, SQLE, CBR3 MLNR 2024/4885GHSR 3280/4885

“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.