SCHEMBL28047041

SCHEMBL28047041

CCOC(=O)c1sc(C)nc1Oc1cc(Cl)ccc1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.52
KDM4E B2RXH2 2/20 0.52
TRPM8 Q7Z2W7 2/20 0.47
CDC7 O00311 2/20 0.47
DBF4 Q9UBU7 2/20 0.47
NPSR1 Q6W5P4 3/20 0.45
GAA P10253 2/20 0.45
GPR55 Q9Y2T6 1/20 0.45
ALDH1A1 P00352 3/20 0.45
KMT2A Q03164 3/20 0.43
NPC1 O15118 2/20 0.43
MEN1 O00255 2/20 0.43
HTT P42858 2/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
DHODH Q02127 4/20 0.42
ALOX15 P16050 1/20 0.41
LMNA P02545 2/20 0.41
MCL1 Q07820 1/20 0.41

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
SCHEMBL28047081 0.88 MAPT (0.47) MAPTKDM4ETRPM8CDC7DBF4
SCHEMBL28047023 0.85 RHEB (0.42) MAPTKDM4EALDH1A1KMT2ANPC1
SCHEMBL28047003 0.84 MAPT (0.46) MAPTKDM4ETRPM8CDC7DBF4
SCHEMBL3455065 0.75 TRPM8 (0.52) MAPTKDM4ETRPM8ALDH1A1KMT2A
SCHEMBL28117752 0.75 GPBAR1 (0.50) MAPTKDM4ECDC7DBF4NPSR1
SCHEMBL929854 0.74 CDC7 (0.53) MAPTKDM4ETRPM8CDC7DBF4
SCHEMBL2218115 0.73 MAPT (0.43) MAPTKDM4ENPSR1GAAGPR55
SCHEMBL2215954 0.73 GPBAR1 (0.61) MAPTALDH1A1HPGD
SCHEMBL1966993 0.73 MAPT (0.62) MAPTKDM4ETRPM8CDC7DBF4
SCHEMBL5651486 0.72 CDC7 (0.59) MAPTKDM4ECDC7DBF4NPSR1

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
CN-105164112-A Amide compound and preparation method, pharmaceutical composition and application thereof SHANGHAI INST MATERIA MEDICA 2015-12-16 CN disclosed