SCHEMBL4004428

SCHEMBL4004428

Cc1cc(CCl)c(C2CCN(C(=O)OC(C)(C)C)CC2)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
KDM4E B2RXH2 1/20 0.47
THRB P10828 1/20 0.47
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
STS P08842 3/20 0.43
TP53 P04637 1/20 0.42
POLB P06746 1/20 0.42
GPR119 Q8TDV5 4/20 0.42
NPSR1 Q6W5P4 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
DPP4 P27487 1/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
USP2 O75604 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL4465793 0.91 MAPT (0.47) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL5150276 0.87 MAPT (0.44) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL4454518 0.87 GPR119 (0.44) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL5154507 0.84 MEN1 (0.42) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL13671244 0.84 MAPT (0.49) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL31342620 0.84 MAPT (0.49) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL19702760 0.83 MAPT (0.53) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL23216278 0.83 ADAM17 (0.48) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL4455329 0.83 KMT2A (0.52) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL13671300 0.83 MAPT (0.48) MAPTKDM4ETHRBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090253744-A1 Acylated piperidine derivatives as melanocortin-4 receptor modulators MERCK SHARP & DOHME CORP. 2009-10-08 US disclosed
US-20090253744-A1 Acylated piperidine derivatives as melanocortin-4 receptor modulators MERCK SHARP & DOHME CORP. 2009-10-08 US disclosed
US-20090253744-A1 Acylated piperidine derivatives as melanocortin-4 receptor modulators MERCK SHARP & DOHME CORP. 2009-10-08 US disclosed
EP-2068867-A2 ACYLATED PIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS Merck & Co., Inc. (US) 2009-06-17 EP disclosed
WO-2008039418-A2 ACYLATED PIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS MERCK & CO., INC. (US) 2008-04-03 WO disclosed
WO-2008039418-A2 ACYLATED PIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS MERCK & CO., INC. (US) 2008-04-03 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-20090253744-A1 Acylated piperidine derivatives as melanocortin-4 receptor modulators MC4R, MC5R, MC3R MAPT 2788/4885KDM4E 347/4885THRB 381/4885

“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.