SCHEMBL8802912

SCHEMBL8802912

O=C(O)c1c[nH]c2cc(N3CCCC3)ccc2c1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
ALDH1A1 P00352 2/20 0.54
CYP1A2 P05177 2/20 0.54
ALOX12 P18054 1/20 0.54
HSD17B10 Q99714 4/20 0.51
KDM4E B2RXH2 2/20 0.51
MAPT P10636 2/20 0.51
USP2 O75604 1/20 0.51
POLB P06746 1/20 0.51
PTPN7 P35236 1/20 0.51
IP6K1 Q92551 1/20 0.50
ERCC1 P07992 1/20 0.49
DNASE1 P24855 1/20 0.49
FEN1 P39748 1/20 0.49
ERCC4 Q92889 1/20 0.49
MDH2 P40926 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
GAA P10253 1/20 0.46

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
SCHEMBL9666677 0.97 HPGD (0.54) HPGDMEN1KMT2AALDH1A1CYP1A2
SCHEMBL9443458 0.90 HPGD (0.52) HPGDMEN1KMT2AALDH1A1CYP1A2
SCHEMBL9051473 0.90 HPGD (0.52) HPGDMEN1KMT2AALDH1A1CYP1A2
SCHEMBL9596257 0.89 HSD17B10 (0.59) HPGDMEN1KMT2AALDH1A1CYP1A2
SCHEMBL9288586 0.88 HPGD (0.57) HPGDMEN1KMT2AALDH1A1CYP1A2
SCHEMBL476730 0.86 HPGD (0.45) HPGDMEN1KMT2AALDH1A1CYP1A2
SCHEMBL476838 0.86 HPGD (0.45) HPGDMEN1KMT2AALDH1A1CYP1A2
SCHEMBL29728320 0.84 HPGD (0.52) HPGDMEN1KMT2AALDH1A1CYP1A2
SCHEMBL27541984 0.83 HPGD (0.47) HPGDMEN1KMT2AALDH1A1CYP1A2
SCHEMBL15557018 0.81 HPGD (0.46) HPGDMEN1KMT2AALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0757990-A1 7-(1-Pyrrolidoinyl)-3-quinolone and naphthyridone carboxylic acid derivatives, method for their preparation and for substituted mono- and bicyclic pyrrolidine intermediates, and their antibacterial and feed additive compositions BAYER AG (DE) 1997-02-12 EP disclosed