SCHEMBL8980312

SCHEMBL8980312

CC(=O)Nc1ccc2[nH]c(-c3cccc(Cl)c3)cc(=O)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.72
KDM4E B2RXH2 4/20 0.72
HPGD P15428 4/20 0.72
SMN1; SMN2 Q16637 1/20 0.72
MAPT P10636 5/20 0.61
PDE10A Q9Y233 1/20 0.58
ESR1 P03372 1/20 0.58
KMT2A Q03164 6/20 0.56
MEN1 O00255 5/20 0.56
THRB P10828 2/20 0.56
MTNR1A P48039 1/20 0.51
MTNR1B P49286 1/20 0.51
ERCC1 P07992 1/20 0.50
DNASE1 P24855 1/20 0.50
FEN1 P39748 1/20 0.50
ERCC4 Q92889 1/20 0.50

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
SCHEMBL8980242 0.87 PDE10A (0.76) ALDH1A1KDM4EHPGDSMN1; SMN2MAPT
SCHEMBL8980474 0.86 ALDH1A1 (0.72) ALDH1A1KDM4EHPGDSMN1; SMN2MAPT
SCHEMBL8980346 0.84 ALDH1A1 (1.00) ALDH1A1KDM4EHPGDSMN1; SMN2MAPT
SCHEMBL6295907 0.81 ALDH1A1 (0.81) ALDH1A1KDM4EHPGDSMN1; SMN2MAPT
SCHEMBL6300496 0.76 ALDH1A1 (0.82) ALDH1A1KDM4EHPGDSMN1; SMN2MAPT
SCHEMBL8980201 0.76 PDE10A (0.72) ALDH1A1KDM4EHPGDMAPTPDE10A
SCHEMBL10223078 0.74 KDM4E (0.57) ALDH1A1KDM4EHPGDSMN1; SMN2MAPT
SCHEMBL3204484 0.72 FFAR1 (0.50) ALDH1A1KDM4EHPGDSMN1; SMN2MAPT
SCHEMBL9387850 0.72 KDM4E (0.70) ALDH1A1KDM4EHPGDSMN1; SMN2PDE10A
SCHEMBL30935740 0.71 KMT2A (1.00) ALDH1A1KDM4EHPGDSMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5571822-A AMINO-2-PHENYL-4-QUINOLONE DERIVATIVES THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1996-11-05 US disclosed
WO-1996010563-A1 2-ARYL-4-QUINOLONES AS ANTITUMOR COMPOUNDS THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1996-04-11 WO disclosed