SCHEMBL6513102

SCHEMBL6513102

CC(C)(C)OC(=O)N1CCC(C(=O)NCCO)(C2CCCCC2)CC1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.46
HPGD P15428 1/20 0.45
MC4R P32245 1/20 0.40
MC5R P33032 1/20 0.40
GPR119 Q8TDV5 3/20 0.39
RECQL P46063 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
PKM P14618 1/20 0.38
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
EPHX2 P34913 1/20 0.37
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
USP2 O75604 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ABL1 P00519 1/20 0.36
RIN1 Q13671 1/20 0.36

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
SCHEMBL1324396 0.83 EPHX1 (0.50) EPHX1HPGDMC4RMC5RRECQL
SCHEMBL6507349 0.80 EPHX1 (0.52) EPHX1HPGDMC4RMC5RGPR119
SCHEMBL4609802 0.80 EPHX1 (0.51) EPHX1HPGDGPR119RECQLMEN1
SCHEMBL1310084 0.79 EPHX1 (0.48) EPHX1HPGDMC4RMC5RGPR119
SCHEMBL23439148 0.79 EPHX1 (0.50) EPHX1HPGDGPR119RECQLPKM
SCHEMBL396843 0.79 EPHX1 (0.49) EPHX1HPGDGPR119RECQLMEN1
SCHEMBL6528107 0.77 MC4R (0.51) EPHX1HPGDMC4RMC5R
SCHEMBL1308169 0.77 EPHX1 (0.46) EPHX1HPGDMC4RMC5RGPR119
SCHEMBL14085893 0.77 EPHX1 (0.48) EPHX1HPGDGPR119RECQLMEN1
SCHEMBL4610629 0.77 EPHX1 (0.48) EPHX1HPGDGPR119RECQLMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005047253-A1 MELANOCORTIN RECEPTOR AGONISTS LG LIFE SCIENCES LTD. (KR) 2005-05-26 WO disclosed