SCHEMBL28692829

SCHEMBL28692829

OC(CCl)CNc1ccc(N2CCOCC2)c(Cl)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.56
ALDH1A1 P00352 8/20 0.56
SMN1; SMN2 Q16637 7/20 0.56
RAB9A P51151 6/20 0.56
NPC1 O15118 5/20 0.56
TSHR P16473 3/20 0.56
LMNA P02545 5/20 0.51
HTT P42858 5/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
MAPK1 P28482 2/20 0.51
HPGD P15428 4/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
TP53 P04637 2/20 0.48
GAA P10253 1/20 0.48
ALOX12 P18054 1/20 0.47

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
SCHEMBL12126890 0.87 HTT (0.49) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL2867969 0.87 HTT (0.49) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL5417803 0.87 HTT (0.49) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL28676073 0.82 MAPT (0.54) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL23030168 0.77 HTT (0.49) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL16189751 0.77 NPC1 (0.50) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL15618724 0.77 HTT (0.49) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL15623485 0.77 HTT (0.49) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL28998621 0.76 HTT (0.48) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL4158338 0.75 L3MBTL1 (0.38) MAPTALDH1A1SMN1; SMN2RAB9ANPC1

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-113816918-A Preparation method of linezolid chloro-impurity 江苏吴中医药集团有限公司 2021-12-21 CN disclosed