SCHEMBL7796571

SCHEMBL7796571

CN1c2ccccc2C(C(=O)O)c2c(-c3c(F)cccc3F)cccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
MAPT P10636 1/20 0.45
EGFR P00533 2/20 0.40
SRC P12931 1/20 0.40
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KIF11 P52732 2/20 0.35
PPIA P62937 2/20 0.34
NOTUM Q6P988 1/20 0.34
ALDH1A1 P00352 1/20 0.34
F2 P00734 1/20 0.34
HPGD P15428 1/20 0.34
ATM Q13315 1/20 0.34
CHRM3 P20309 1/20 0.33

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
Acridan SCHEMBL7596523 0.87 MEN1 (0.37) HDAC4HDAC7HDAC5KMT2AMEN1
SCHEMBL7787075 0.84 MAPT (0.39) HDAC4HDAC7HDAC5KMT2AMEN1
SCHEMBL2218310 0.84 HDAC4 (0.50) HDAC4HDAC7HDAC5KMT2AMEN1
SCHEMBL7787066 0.82 HDAC4 (0.44) HDAC4HDAC7HDAC5KMT2AMEN1
SCHEMBL5665141 0.82 HDAC4 (0.44) HDAC4HDAC7HDAC5KMT2AMEN1
SCHEMBL6130200 0.80 HDAC4 (0.46) HDAC4HDAC7HDAC5KMT2AMEN1
SCHEMBL7793163 0.78 HDAC4 (0.44) HDAC4HDAC7HDAC5KMT2AMEN1
SCHEMBL3772653 0.78 HDAC4 (0.44) HDAC4HDAC7HDAC5KMT2AMEN1
SCHEMBL2989515 0.77 HDAC4 (0.66) HDAC4HDAC7HDAC5KMT2AMEN1
SCHEMBL31613807 0.77 HDAC4 (0.66) HDAC4HDAC7HDAC5KMT2AMEN1

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-0750748-B1 NOVEL ARYL N-ALKYLACRIDANCARBOXYLATE DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN INC (US) 2001-12-05 EP claimed