SCHEMBL7386971

SCHEMBL7386971

CCC(C(=O)ON1C(=O)c2ccccc2C1=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
HTT P42858 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
GAA P10253 1/20 0.48
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
HTR1A P08908 1/20 0.45
ADRA1A P35348 1/20 0.45
KDM4E B2RXH2 2/20 0.45
MAPT P10636 2/20 0.45
KCNQ2 O43526 1/20 0.45
ALDH1A1 P00352 2/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
TNF P01375 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
SCHEMBL7381321 0.82 GAA (0.51) LMNAHTTL3MBTL1GAAMEN1
SCHEMBL7379862 0.82 GAA (0.51) LMNAHTTL3MBTL1GAAMEN1
SCHEMBL7384133 0.82 GAA (0.51) LMNAHTTL3MBTL1GAAMEN1
SCHEMBL23969551 0.80 LMNA (0.44) LMNAHTTGAAMEN1KMT2A
SCHEMBL13706557 0.80 ALDH1A1 (0.44) LMNAGAAMEN1KMT2AKDM4E
SCHEMBL30731578 0.80 LMNA (0.44) LMNAHTTGAAMEN1KMT2A
SCHEMBL13479816 0.80 ALDH1A1 (0.45) LMNAL3MBTL1MEN1KMT2AADRA1A
SCHEMBL29439746 0.76 LMNA (0.45) LMNAHTTGAAKMT2AMAPT
SCHEMBL3676819 0.76 LMNA (0.45) LMNAHTTGAAKMT2AMAPT
SCHEMBL28658416 0.76 HTR1A (0.56) LMNAGAAMEN1KMT2AHTR1A

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