SCHEMBL5317341

SCHEMBL5317341

COC(=O)c1cc(NC(=O)CCOc2ccc(F)cc2)ccc1OC(C)=O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 3/20 0.47
LMNA P02545 2/20 0.47
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
MDH1 P40925 1/20 0.44
MDH2 P40926 1/20 0.44
HIF1A Q16665 1/20 0.44
FAAH O00519 1/20 0.44

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
Methoxymethane SCHEMBL5317343 0.91 KMT2A (0.49) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL5318084 0.89 KMT2A (0.55) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL5317042 0.89 MAPT (0.62) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL5317330 0.86 FAAH (0.44) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL5318376 0.85 FAAH (0.46) MAPTMEN1KMT2ARAB9ANPC1
Methoxymethane SCHEMBL5317044 0.81 KMT2A (0.59) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL24074030 0.81 LMNA (0.49) MAPTMEN1KMT2AKDM4EALDH1A1
Methoxymethane SCHEMBL5318086 0.80 KMT2A (0.54) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL5318956 0.79 MEN1 (0.58) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL5318054 0.78 MEN1 (0.59) MAPTMEN1KMT2AKDM4EALDH1A1

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