SCHEMBL7006774

SCHEMBL7006774

CCOC(=O)c1cn(-c2ccc(F)cc2F)c2cc(-c3ccc4c(c3)CN(S(=O)(=O)c3ccc(C)cc3)C4)c(F)cc2c1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.40
KMT2A Q03164 2/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
THRB P10828 1/20 0.40
PIM1 P11309 1/20 0.39
IRAK1 P51617 1/20 0.39
CAMK2B Q13554 1/20 0.39
CAMK2G Q13555 1/20 0.39
CAMK2D Q13557 1/20 0.39
PIM3 Q86V86 1/20 0.39
ROCK2 O75116 1/20 0.38
CDK1 P06493 1/20 0.38
PRKACA P17612 1/20 0.38
CDK2 P24941 1/20 0.38
CSNK1D P48730 1/20 0.38
GSK3A P49840 1/20 0.38
CDK5 Q00535 1/20 0.38
PRKCD Q05655 1/20 0.38
ROCK1 Q13464 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
SCHEMBL7006233 0.90 LMNA (0.43) HPGDKMT2AMAPTMEN1ALDH1A1
SCHEMBL7011639 0.87 HPGD (0.40) HPGDKMT2AMAPTMEN1THRB
SCHEMBL7008233 0.86 HPGD (0.38) HPGDKMT2AMAPTMEN1THRB
SCHEMBL7014300 0.85 HPGD (0.46) HPGDKMT2AMAPTMEN1THRB
SCHEMBL7010716 0.85 HPGD (0.45) HPGDKMT2AMAPTMEN1THRB
SCHEMBL7098456 0.77 LMNA (0.49) HPGDKMT2AMAPTMEN1ALDH1A1
SCHEMBL5258973 0.77 KMT2A (0.57) HPGDKMT2AMAPTMEN1THRB
SCHEMBL7009950 0.77 ALDH1A1 (0.40) HPGDKMT2AMAPTMEN1ALDH1A1
SCHEMBL7011168 0.76 ALDH1A1 (0.49) HPGDKMT2AMAPTMEN1ALDH1A1
SCHEMBL7007055 0.76 LMNA (0.54) HPGDKMT2AMEN1ALDH1A1KDM4E

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