SCHEMBL6510036

SCHEMBL6510036

CN(C)C1(C2CCCCC2)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.50
HPGD P15428 1/20 0.49
OPRM1 P35372 1/20 0.46
OPRL1 P41146 1/20 0.46
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GPR119 Q8TDV5 4/20 0.41
RECQL P46063 1/20 0.41
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
THRB P10828 1/20 0.40
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
PTPN6 P29350 1/20 0.40
ABL1 P00519 1/20 0.40
RIN1 Q13671 1/20 0.40
DDB1 Q16531 2/20 0.40
CRBN Q96SW2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40

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
SCHEMBL6509238 0.87 EPHX1 (0.46) EPHX1HPGDOPRM1OPRL1USP2
SCHEMBL31566758 0.84 DDB1 (0.41) EPHX1HPGDOPRM1OPRL1USP2
SCHEMBL3254458 0.81 EPHX1 (0.54) EPHX1HPGDUSP2SMN1; SMN2GPR119
SCHEMBL4610629 0.81 EPHX1 (0.48) EPHX1HPGDUSP2SMN1; SMN2GPR119
SCHEMBL6529725 0.80 EPHX1 (0.50) EPHX1HPGDUSP2SMN1; SMN2GPR119
SCHEMBL6507267 0.80 EPHX1 (0.52) EPHX1HPGDUSP2SMN1; SMN2GPR119
SCHEMBL23439145 0.80 EPHX1 (0.51) EPHX1HPGDUSP2SMN1; SMN2GPR119
SCHEMBL6132692 0.79 EPHX1 (0.51) EPHX1HPGDUSP2SMN1; SMN2GPR119
SCHEMBL4609802 0.79 EPHX1 (0.51) EPHX1HPGDUSP2SMN1; SMN2GPR119
SCHEMBL34473902 0.79 USP30 (0.46) EPHX1HPGDUSP2SMN1; SMN2GPR119

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