SCHEMBL5199047

SCHEMBL5199047

CCC(CC)C(=O)N(C1CCCCC1)C1CCN(C(=O)O)CC1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
MAPK1 P28482 1/20 0.38
EPHX2 P34913 4/20 0.36
ATM Q13315 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
ADH1C P00326 1/20 0.33
ADH1A P07327 1/20 0.33
HTT P42858 1/20 0.33
THRB P10828 1/20 0.33
HTR2A P28223 1/20 0.33

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
SCHEMBL5195599 0.81 EPHX1 (0.49)
SCHEMBL5197653 0.79 MAPT (0.39) MAPTMAPK1EPHX2ATML3MBTL1
SCHEMBL5195333 0.79 MAPT (0.39) MAPTMAPK1EPHX2ATML3MBTL1
SCHEMBL5197473 0.77 MC4R (0.42)
SCHEMBL5456713 0.77 SLC6A4 (0.39) ATMADH1CADH1A
SCHEMBL27564719 0.74 ALDH1A1 (0.44) MAPTEPHX2ATMADH1CADH1A
SCHEMBL6418241 0.72 KMT2A (0.45) MAPTATML3MBTL1
SCHEMBL5195891 0.72 HTT (0.41) MAPTMAPK1EPHX2ATML3MBTL1
SCHEMBL1311214 0.71 OPRD1 (0.40) HTR2A
SCHEMBL6435389 0.70 KMT2A (0.43) MAPTATML3MBTL1

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
EP-1786809-A2 AMINOPIPERIDINE DERIVATIVES, PREPARATION THEREOF AND USE THEREOF AS MELANOCORTIN RECEPTOR AGONISTS Sanofi-Aventis (FR) 2007-05-23 EP disclosed
WO-2006021656-A2 AMINOPIPERIDINE DERIVATIVES, PREPARATION THEREOF AND USE THEREOF AS MELANOCORTIN RECEPTOR AGONISTS SANOFI-AVENTIS (FR) 2006-03-02 WO disclosed