SCHEMBL5458096

SCHEMBL5458096

CCN(CC)C(=O)N(C1CCCCC1)C1CCN(C(=O)[C@@H](Cc2ccc(Cl)cc2)N[C@H]2CC[C@@H](NC(=O)C(F)(F)F)CC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MC4R P32245 10/20 0.41
TACR2 P21452 1/20 0.38
TACR1 P25103 1/20 0.38
MC5R P33032 1/20 0.37
MC3R P41968 1/20 0.37
MC1R Q01726 1/20 0.37
AVPR1A P37288 7/20 0.37
OXTR P30559 1/20 0.36

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
SCHEMBL5447100 1.00 MC4R (0.41) MC4RTACR2TACR1MC5RMC3R
SCHEMBL5447104 1.00 MC4R (0.41) MC4RTACR2TACR1MC5RMC3R
SCHEMBL5453829 0.93 TACR2 (0.41) MC4RTACR2TACR1MC5RMC3R
SCHEMBL5443890 0.93 TACR2 (0.41) MC4RTACR2TACR1MC5RMC3R
SCHEMBL5443887 0.93 TACR2 (0.41) MC4RTACR2TACR1MC5RMC3R
SCHEMBL5214537 0.90 MC4R (0.43) MC4RAVPR1A
SCHEMBL5458234 0.90 MC4R (0.43) MC4RAVPR1A
SCHEMBL5214527 0.90 MC4R (0.43) MC4RAVPR1A
SCHEMBL5449594 0.88 CYP51A1 (0.44) MC4RMC5RMC3RMC1R
SCHEMBL5453848 0.88 MC4R (0.45) MC4RMC5RMC3RMC1R

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-20070191364-A1 AMINOPIPERIDINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-08-16 US claimed
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 1/4885TACR2 216/4885TACR1 147/4885

“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.