SCHEMBL7764271

SCHEMBL7764271

CC(=O)C1=C(C)NC2=C(C(=O)CC(C)(C)C2)C1c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.62
NCOA1 Q15788 1/20 0.62
NCOA3 Q9Y6Q9 1/20 0.62
KDM4E B2RXH2 14/20 0.60
ALDH1A1 P00352 12/20 0.60
GAA P10253 8/20 0.60
MAPT P10636 3/20 0.57
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
MAPK1 P28482 2/20 0.57
LMNA P02545 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
HSD17B10 Q99714 4/20 0.57
GSK3A P49840 3/20 0.57
GSK3B P49841 3/20 0.57
TSHR P16473 3/20 0.57
CSNK1D P48730 1/20 0.57
CASP1 P29466 3/20 0.56
RECQL P46063 1/20 0.56

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
SCHEMBL13461463 0.91 KDM4E (0.61) KDM4EALDH1A1GAAMAPTKMT2A
SCHEMBL12135791 0.87 KDM4E (0.73) HTTKDM4EALDH1A1GAAMAPT
SCHEMBL5227533 0.85 KDM4E (0.65) KDM4EALDH1A1GAAMAPTKMT2A
SCHEMBL20657021 0.85 KDM4E (0.77) KDM4EALDH1A1GAAHSD17B10TSHR
SCHEMBL7814667 0.82 MAPT (0.73) HTTKDM4EALDH1A1GAAMAPT
SCHEMBL3323327 0.82 KDM4E (0.79) KDM4EALDH1A1GAAHSD17B10TSHR
SCHEMBL3322661 0.82 KDM4E (0.76) KDM4EALDH1A1GAALMNAHSD17B10
SCHEMBL12136008 0.82 HTT (0.50) HTTNCOA1NCOA3KDM4EALDH1A1
SCHEMBL16854539 0.81 NOTCH1 (0.79) KDM4EALDH1A1GAATDP1HSD17B10
SCHEMBL3329623 0.81 KDM4E (0.68) HTTKDM4EALDH1A1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0665834-B1 QUINOLONE AND ACRIDINONE DERIVATIVES FOR THE TREATMENT OF URINARY INCONTINENCE ASTRAZENECA AB (SE) 2001-05-30 EP claimed
US-5455253-A For urinary incontinence ZENECA LIMITED (GB) 1995-10-03 US claimed
WO-1994008966-A1 QUINOLONE AND ACRIDINONE DERIVATIVES FOR THE TREATMENT OF URINARY INCONTINENCE ZENECA LIMITED (GB) 1994-04-28 WO claimed
EP-0755382-B1 QUINOLONE DERIVATIVE FOR TREATMENT OF URINARY INCONTINENCE ASTRAZENECA AB (SE) 2001-06-13 EP disclosed
EP-0665834-B1 QUINOLONE AND ACRIDINONE DERIVATIVES FOR THE TREATMENT OF URINARY INCONTINENCE ASTRAZENECA AB (SE) 2001-05-30 EP disclosed
US-5622964-A ADMINISTERING 4,6,7,8-TETRAHYDRO-5(1H)-QUINOLONE DERIVATIVE TO TREAT ASTHMA IN MAMMALS ZENECA LIMITED (GB) 1997-04-22 US disclosed
US-5455253-A For urinary incontinence ZENECA LIMITED (GB) 1995-10-03 US disclosed
WO-1994008966-A1 QUINOLONE AND ACRIDINONE DERIVATIVES FOR THE TREATMENT OF URINARY INCONTINENCE ZENECA LIMITED (GB) 1994-04-28 WO disclosed