SCHEMBL28064163

SCHEMBL28064163

O=C(Cc1cncs1)ON1CCC(CCOc2cccc(Cl)c2Cl)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
KMT2A Q03164 2/20 0.38
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GPBAR1 Q8TDU6 1/20 0.37
KDM4E B2RXH2 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
HTR7 P34969 2/20 0.34
HPGD P15428 2/20 0.34
MEN1 O00255 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
PPARG P37231 2/20 0.34
PPARD Q03181 2/20 0.34
PPARA Q07869 2/20 0.34
DRD2 P14416 2/20 0.33
HTR1A P08908 1/20 0.33
HTR6 P50406 1/20 0.33
IDO1 P14902 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 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
SCHEMBL28064203 0.85 PPARG (0.46) HTR7PPARGPPARDPPARA
SCHEMBL28064102 0.85 KDM4E (0.41) ALDH1A1KMT2AGAAL3MBTL1KDM4E
SCHEMBL28088194 0.84 PPARG (0.40) ALDH1A1KDM4ESMN1; SMN2PPARGPPARD
SCHEMBL28064060 0.83 LTA4H (0.39) ALDH1A1KMT2AHPGDMEN1PPARG
SCHEMBL28064081 0.83 PTGDR2 (0.40) KMT2AHTR7MEN1PPARGHTR1A
SCHEMBL28064084 0.83 TEAD1 (0.47) ALDH1A1PPARGPPARDPPARA
SCHEMBL28064071 0.83 ALDH1A1 (0.38) ALDH1A1KMT2AGAAL3MBTL1KDM4E
SCHEMBL28064164 0.83 SIGMAR1 (0.38) ALDH1A1KMT2AGAAL3MBTL1KDM4E
SCHEMBL2228348 0.82 HTT (0.39) ALDH1A1KMT2AGAAL3MBTL1GPBAR1
SCHEMBL28064086 0.81 LTA4H (0.39) KMT2ASMN1; SMN2MEN1MAPT

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
CN-102803258-B Alkyl-heterocyclic carbamate derivatives, their preparation and therapeutic use SAI NUOFEI (FR) 2016-04-20 CN claimed
CN-105837565-A ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION 赛诺菲 2016-08-10 CN disclosed
CN-102803258-B Alkyl-heterocyclic carbamate derivatives, their preparation and therapeutic use SAI NUOFEI (FR) 2016-04-20 CN disclosed