SCHEMBL5320993

SCHEMBL5320993

COC(=O)c1cc(NC(=O)COc2ccc(Cl)cc2Cl)ccc1OC(C)=O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.66
KMT2A Q03164 4/20 0.66
L3MBTL1 Q9Y468 2/20 0.59
MAPT P10636 6/20 0.55
RAB9A P51151 3/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2C19 P33261 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
HPGD P15428 4/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
MAPK1 P28482 3/20 0.54
LMNA P02545 2/20 0.54
TSHR P16473 2/20 0.53
KDM4E B2RXH2 1/20 0.53
HSD17B10 Q99714 1/20 0.53
ACHE P22303 1/20 0.52
TP53 P04637 2/20 0.52
NPC1 O15118 1/20 0.51
PKM P14618 1/20 0.51

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
SCHEMBL5316761 0.91 MEN1 (0.54) MEN1KMT2AL3MBTL1MAPTNPSR1
Methoxymethane SCHEMBL5320997 0.90 MEN1 (0.65) MEN1KMT2AL3MBTL1MAPTRAB9A
SCHEMBL5318054 0.88 MEN1 (0.59) MEN1KMT2AL3MBTL1MAPTRAB9A
SCHEMBL5317336 0.83 S1PR4 (0.51) MEN1KMT2AL3MBTL1MAPTRAB9A
Methoxymethane SCHEMBL5316763 0.82 POLB (0.53) MEN1KMT2AL3MBTL1MAPTNPSR1
SCHEMBL4297872 0.82 MEN1 (0.75) MEN1KMT2AL3MBTL1MAPTRAB9A
SCHEMBL5318956 0.80 MEN1 (0.58) MEN1KMT2AMAPTHPGDSMN1; SMN2
SCHEMBL10016463 0.80 MEN1 (1.00) MEN1KMT2AL3MBTL1MAPTRAB9A
SCHEMBL27374650 0.80 MEN1 (0.84) MEN1KMT2AL3MBTL1MAPTRAB9A
SCHEMBL5318084 0.79 KMT2A (0.55) MEN1KMT2AMAPTRAB9AHPGD

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-2007119984-A1 SALICYLIC ACID DERIVATIVE COMPOUND AND PHARMACEUTICAL COMPOSITION CONTAINING THEM NEUROTECH CO., LTD. (KR) 2007-10-25 WO disclosed