SCHEMBL752047

SCHEMBL752047

C[C@@H]1CN(C(=O)[C@@H]2CN(c3cccnn3)C[C@H]2c2ccc(Cl)cn2)C[C@H](C)[C@@]1(O)c1ccccn1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MC4R P32245 17/20 0.68
MC3R P41968 8/20 0.68
MC1R Q01726 3/20 0.68
KCNH2 Q12809 3/20 0.47
MC5R P33032 3/20 0.47
GRM1 Q13255 1/20 0.33
TRPM5 Q9NZQ8 1/20 0.33
AVPR1A P37288 1/20 0.32

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
SCHEMBL733770 1.00 MC4R (0.68) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL733769 1.00 MC4R (0.68) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL762932 0.91 MC4R (0.69) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL732493 0.87 MC4R (0.52) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL732492 0.87 MC4R (0.52) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL733760 0.86 MC4R (0.69) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL733761 0.86 MC4R (0.69) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL733104 0.82 MC4R (0.53) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL733105 0.82 MC4R (0.53) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL752025 0.82 MC4R (0.53) MC4RMC3RMC1RKCNH2MC5R

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-8138188-B2 Melanocortin type 4 receptor agonist piperidinoylpyrrolidines PFIZER INC. (US) 2012-03-20 US disclosed
US-20090036459-A1 Melanocortin Type 4 Receptor Agonist Piperidinoylpyrrolidines PFIZER INC 2009-02-05 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-20090036459-A1 Melanocortin Type 4 Receptor Agonist Piperidinoylpyrrolidines MC4R, MC5R, MC3R MC4R 1/4885MC3R 3/4885MC1R 4/4885

“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.