SCHEMBL4700841

SCHEMBL4700841

COC(CN(C)C(=O)Nc1ccccc1C1CCN(C(=O)O)CC1)OC

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
RBP4 P02753 4/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
HRH3 Q9Y5N1 2/20 0.36
CHRM4 P08173 2/20 0.36
CHRM1 P11229 1/20 0.36
BRD4 O60885 1/20 0.36
UBE2M P61081 1/20 0.35
DCUN1D1 Q96GG9 1/20 0.35
ABCC1 P33527 1/20 0.35
TACR1 P25103 1/20 0.35
ACHE P22303 1/20 0.35
BACE1 P56817 1/20 0.35

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
SCHEMBL4682167 0.87 NAMPT (0.44) MEN1KMT2ASMN1; SMN2
SCHEMBL4700022 0.81 BRD4 (0.44) MEN1KMT2ARBP4SMN1; SMN2CYP2D6
SCHEMBL4700847 0.79 BRD4 (0.43) MEN1KMT2ARBP4SMN1; SMN2CYP2D6
SCHEMBL6606758 0.76 KMT2A (0.47) MEN1KMT2ARBP4CYP2D6CYP2C19
SCHEMBL4220697 0.74 LMNA (0.53) CYP2C19UBE2MDCUN1D1
SCHEMBL4222732 0.72 UBE2M (0.46) UBE2MDCUN1D1
SCHEMBL4678774 0.69 EPHX2 (0.48) KMT2ACHRM1
SCHEMBL4679835 0.69 TACR1 (0.51) MEN1KMT2ARBP4CYP2D6CYP2C19
SCHEMBL6326316 0.69 GPR119 (0.46) BRD4
SCHEMBL750673 0.68 RBP4 (0.55) MEN1KMT2ARBP4SMN1; SMN2CYP2D6

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 MEN1 1124/4885KMT2A 1616/4885RBP4 1528/4885

“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.