SCHEMBL7787035

SCHEMBL7787035

COc1cccc(OC)c1OC(=O)C1c2ccccc2N(C)c2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.49
HDAC7 Q8WUI4 1/20 0.49
HDAC5 Q9UQL6 1/20 0.49
HTT P42858 2/20 0.44
HSD17B10 Q99714 1/20 0.44
NFE2L2 Q16236 2/20 0.41
KDM4E B2RXH2 3/20 0.39
LMNA P02545 3/20 0.39
ALDH1A1 P00352 2/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
EGFR P00533 1/20 0.39
SRC P12931 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
GAA P10253 2/20 0.38
FABP7 O15540 1/20 0.38
FABP3 P05413 1/20 0.38
FABP5 Q01469 1/20 0.38
GLA P06280 1/20 0.38

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
SCHEMBL38662006 1.00 HDAC4 (0.49) HDAC4HDAC7HDAC5HTTHSD17B10
SCHEMBL38662442 0.92 HDAC4 (0.45) HDAC4HDAC7HDAC5HTTHSD17B10
SCHEMBL8741687 0.89 HDAC4 (0.51) HDAC4HDAC7HDAC5HTTKDM4E
SCHEMBL38661859 0.85 HDAC4 (0.46) HDAC4HDAC7HDAC5LMNATSHR
SCHEMBL38664478 0.83 HDAC4 (0.51) HDAC4HDAC7HDAC5HSD17B10KDM4E
SCHEMBL13005786 0.83 HDAC4 (0.51) HDAC4HDAC7HDAC5HSD17B10LMNA
SCHEMBL6254107 0.83 HDAC4 (0.51) HDAC4HDAC7HDAC5HSD17B10KDM4E
SCHEMBL7787087 0.83 HDAC4 (0.51) HDAC4HDAC7HDAC5HSD17B10LMNA
SCHEMBL5448645 0.82 HDAC4 (0.50) HDAC4HDAC7HDAC5LMNAALDH1A1
SCHEMBL38663637 0.82 HDAC4 (0.50) HDAC4HDAC7HDAC5LMNAALDH1A1

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 6 patents. 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 disclosed
US-5750698-A USEFUL IN DETECTING BOTH PEROXIDASE AND PEROXIDE LUMIGEN, INC. (US) 1998-05-12 US disclosed
EP-0750748-A4 NOVEL ARYL N-ALKYLACRIDANCARBOXYLATE DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN INC (US) 1997-04-16 EP disclosed
US-5593845-A BY REACTION WITH PEROXIDES AND PEROXIDASE; DETECTION OF HAPTENS, PROTEINS, ANTIBODIES IN ENZYME IMMUNOASSAY LUMIGEN, INC. (US) 1997-01-14 US disclosed
EP-0750748-A1 NOVEL ARYL N-ALKYLACRIDANCARBOXYLATE DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN, INC. (US) 1997-01-02 EP disclosed
WO-1995023971-A1 NOVEL ARYL N-ALKYLACRIDANCARBOXYLATE DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN, INC. (US) 1995-09-08 WO disclosed