SCHEMBL6561804

SCHEMBL6561804

O=C1C[C@H](C(=O)OC(=O)c2ccccc2)CO1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.47
MAPT P10636 3/20 0.39
LMNA P02545 2/20 0.39
KDM4E B2RXH2 1/20 0.39
F2 P00734 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ELANE P08246 1/20 0.38
TSHR P16473 2/20 0.37
GRM5 P41594 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
BCHE P06276 1/20 0.35
TP53 P04637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CHRNA7 P36544 1/20 0.34

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
SCHEMBL6560271 1.00 HTT (0.47) HTTMAPTLMNAKDM4EF2
SCHEMBL5238501 0.79 HTT (0.71) HTTMAPTLMNAKDM4EKMT2A
SCHEMBL29277477 0.78 ELANE (0.56) MAPTLMNAF2KMT2AMEN1
SCHEMBL10029748 0.76 F2 (0.42) MAPTLMNAKDM4EF2KMT2A
SCHEMBL5582384 0.75 CHRNA7 (0.49) MAPTLMNAF2KMT2AMEN1
SCHEMBL27598256 0.75 CHRNA7 (0.49) MAPTLMNAF2KMT2AMEN1
SCHEMBL2696973 0.75 CHRNA7 (0.49) MAPTLMNAF2KMT2AMEN1
SCHEMBL5401016 0.74 ELANE (0.55) HTTLMNAF2KMT2AMEN1
SCHEMBL5788955 0.72 ELANE (0.58) HTTLMNAF2KMT2AMEN1
SCHEMBL28937493 0.72 SLC6A3 (0.50) MAPTLMNAF2KMT2AELANE

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
EP-1398312-A1 Beta-substituted-gamma-butyrolactones and a process for preparation thereof Uh, Hong-Sun (KR) 2004-03-17 EP claimed