SCHEMBL4697699

SCHEMBL4697699

CC(C)(C)OC(=O)N1CCC(c2ccccc2N(CC2CC2)S(C)(=O)=O)CC1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MC4R P32245 3/20 0.55
LIMK2 P53671 1/20 0.47
STS P08842 1/20 0.45
KDM4E B2RXH2 2/20 0.45
PKM P14618 1/20 0.45
GPR119 Q8TDV5 10/20 0.45
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
PTPRB P23467 1/20 0.42
PTPN11 Q06124 1/20 0.42
NAMPT P43490 1/20 0.42

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
SCHEMBL4679488 0.85 MC4R (0.43) MC4R
SCHEMBL5332549 0.84 MC4R (0.70) MC4RLIMK2
SCHEMBL8332423 0.84 GPR119 (0.49) LIMK2STSKDM4EGPR119MAPT
SCHEMBL4701631 0.82 BRD4 (0.43) MC4RSTSKDM4EPKMGPR119
SCHEMBL7799838 0.82 LIMK2 (0.55) MC4RLIMK2STSKDM4EPKM
SCHEMBL13671270 0.82 MC4R (0.46) MC4RSTSKDM4EGPR119MAPT
SCHEMBL5338150 0.81 MC4R (0.65) MC4RLIMK2
SCHEMBL6608621 0.80 GPR119 (0.53) KDM4EPKMGPR119MAPTTHRB
SCHEMBL5338194 0.80 MC4R (0.64) MC4R
SCHEMBL4701517 0.80 MC4R (0.65) MC4R

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-1416933-B1 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEM INC (US) 2008-01-02 EP disclosed
US-6977264-B2 Substituted piperidines and methods of use AMGEN INC. (US) 2005-12-20 US disclosed
US-20040006067-A1 Substituted piperidines and methods of use AMGEN INC. 2004-01-08 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-20040006067-A1 Substituted piperidines and methods of use MC4R, MC5R, MC1R MC4R 1/4885LIMK2 4194/4885STS 1815/4885

“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.