SCHEMBL7005348

SCHEMBL7005348

CCOC(=O)c1cn(C2CC2)c2nc(-c3ccc4c(c3)CN(S(=O)(=O)c3ccc(C)cc3)C4)c(F)cc2c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.41
ADRB2 P07550 1/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 2/20 0.38
LMNA P02545 2/20 0.38
HSD17B10 Q99714 2/20 0.38
ABCC4 O15439 1/20 0.38
TSHR P16473 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CHRM2 P08172 1/20 0.37
DRD1 P21728 1/20 0.37
DPP4 P27487 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CREBBP Q92793 1/20 0.37
HDAC1 Q13547 1/20 0.37

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
SCHEMBL7006784 0.90 TOP2A (0.46) KDM4ELMNAHSD17B10ABCC4CHRM2
SCHEMBL7010716 0.86 HPGD (0.45) HPGDADRB2MEN1MAPTTHRB
SCHEMBL7011639 0.85 HPGD (0.40) HPGDMEN1MAPTTHRBKMT2A
SCHEMBL7008129 0.85 ADRB2 (0.44) HPGDADRB2MEN1MAPTTHRB
SCHEMBL7010320 0.85 TOP2A (0.49) HPGDADRB2MEN1MAPTTHRB
SCHEMBL7008688 0.85 ADRB2 (0.45) HPGDADRB2MEN1MAPTTHRB
SCHEMBL7010122 0.83 ADRB2 (0.43) HPGDADRB2MEN1MAPTTHRB
SCHEMBL7509004 0.83 ADRB2 (0.44) HPGDADRB2MEN1MAPTTHRB
SCHEMBL7007102 0.82 ADRB2 (0.42) HPGDADRB2MEN1MAPTTHRB
SCHEMBL7010280 0.82 ADRB2 (0.42) HPGDADRB2MEN1MAPTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0775702-B1 NOVEL QUINOLONE- OR NAPHTHYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO LTD (JP) 2003-07-23 EP disclosed
US-5935952-A ANTIBACTERIAL AGENT TOYAMA CHEMICAL CO., LTD. (JP) 1999-08-10 US disclosed
EP-0775702-A1 NOVEL QUINOLONE- OR NAPHTHYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 1997-05-28 EP disclosed