SCHEMBL7384133

SCHEMBL7384133

CC[C@@H](C(=O)ON1C(=O)CCC1=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.51
LMNA P02545 4/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 5/20 0.44
HSD17B10 Q99714 2/20 0.43
TSHR P16473 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
BCHE P06276 1/20 0.42

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
SCHEMBL7379862 1.00 GAA (0.51) GAALMNAMEN1KMT2AKDM4E
SCHEMBL7381321 1.00 GAA (0.51) GAALMNAMEN1KMT2AKDM4E
SCHEMBL7386971 0.82 LMNA (0.48) GAALMNAMEN1KMT2AKDM4E
SCHEMBL2125273 0.81 ALDH1A1 (0.46) GAALMNAMEN1KMT2AALDH1A1
SCHEMBL7170395 0.80 PTGS2 (0.40) GAALMNAMEN1KMT2AALDH1A1
SCHEMBL28275642 0.80 TSHR (0.41) GAAMEN1KMT2AKDM4EALDH1A1
SCHEMBL14979298 0.80 L3MBTL1 (0.44) LMNAMEN1KMT2AALDH1A1HSD17B10
SCHEMBL18932974 0.79 GAA (0.36) GAALMNAMEN1KMT2AKDM4E
SCHEMBL18932917 0.79 HDAC3 (0.38) GAALMNAMEN1KMT2AKDM4E
SCHEMBL1175379 0.78 LMNA (0.46) LMNAKMT2AALDH1A1HSD17B10

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5281617-A Enzyme inhibitor CORTECH, INC. (US) 1994-01-25 US claimed
US-5281617-A Enzyme inhibitor CORTECH, INC. (US) 1994-01-25 US disclosed