SCHEMBL16846207

SCHEMBL16846207

CC(C)(C)OC(=O)N[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)N1CCNCC1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MC4R P32245 13/20 0.66
UGCG Q16739 4/20 0.63
CYP3A4 P08684 3/20 0.53
MC3R P41968 3/20 0.47
MC5R P33032 1/20 0.46
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
PKM P14618 1/20 0.45
HPGD P15428 1/20 0.45
ALOX12 P18054 1/20 0.45

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
SCHEMBL21674357 1.00 MC4R (0.66) MC4RUGCGCYP3A4MC3RMC5R
SCHEMBL16825980 0.89 MC4R (0.69) MC4RUGCGCYP3A4MC3RMC5R
SCHEMBL16846209 0.88 MC4R (0.58) MC4RUGCGMC3R
SCHEMBL2795241 0.85 KMT2A (0.52) MC4RUGCGCYP3A4MC3RMC5R
SCHEMBL4771336 0.85 MC4R (0.72) MC4RUGCGCYP3A4MC3RMC5R
SCHEMBL4795886 0.85 MC4R (0.72) MC4RUGCGCYP3A4MC3RMC5R
SCHEMBL16825736 0.84 UGCG (0.71) MC4RUGCGCYP3A4MC3R
SCHEMBL29868437 0.83 MC4R (0.60) MC4RUGCGCYP3A4MC3RMC5R
SCHEMBL29868450 0.83 MC4R (0.60) MC4RUGCGCYP3A4MC3RMC5R
SCHEMBL6730395 0.82 MC4R (0.59) MC4RUGCGCYP3A4MC3RMC5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3082805-B1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME INST FOR DRUG DISCOVERY LLC (US) 2020-02-05 EP disclosed
US-20160297823-A1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME INSTITUTE FOR DRUG DISCOVERY, LLC 2016-10-13 US disclosed
WO-2015095701-A1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME THE INSTITUTE FOR DRUG DELIVERY (US) 2015-06-25 WO 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-20160297823-A1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME CMA1, CHIA, AADAC MC4R 1089/4885UGCG 551/4885CYP3A4 493/4885

“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.