SCHEMBL5459398

SCHEMBL5459398

O=C([C@@H](Cc1ccc(Cl)cc1)NC1CCNCC1)N1CCC(N(CCn2ccnc2)C2CCCCC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MC4R P32245 17/20 0.40
MC5R P33032 1/20 0.39
MC3R P41968 1/20 0.39
MC1R Q01726 1/20 0.39
CYP51A1 Q16850 1/20 0.37

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
Hydrochloric Acid SCHEMBL5447607 0.99 MC4R (0.40) MC4RMC5RMC3RMC1RCYP51A1
SCHEMBL5197889 0.92 MC4R (0.38) MC4R
SCHEMBL5449611 0.87 GPR119 (0.42) MC4R
SCHEMBL5444005 0.83 MC4R (0.42) MC4RMC5RMC3RMC1RCYP51A1
Hydrochloric Acid SCHEMBL5458137 0.82 MC4R (0.42) MC4RMC5RMC3RMC1RCYP51A1
SCHEMBL5454784 0.79 MC4R (0.46) MC4RMC5RMC3RMC1RCYP51A1
SCHEMBL5461302 0.78 MC4R (0.43) MC4RMC5RMC3RMC1RCYP51A1
Hydrochloric Acid SCHEMBL5449626 0.78 MC4R (0.43) MC4RMC5RMC3RMC1RCYP51A1
SCHEMBL5450753 0.76 MC4R (0.44) MC4RMC5RMC3RMC1RCYP51A1
SCHEMBL5451880 0.75 CYP51A1 (0.47) MC4RMC5RMC3RMC1RCYP51A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070191364-A1 AMINOPIPERIDINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-08-16 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-20070191364-A1 AMINOPIPERIDINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF MC4R, MC5R, TAAR5 MC4R 1/4885MC5R 2/4885MC3R 6/4885

“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.