SCHEMBL2925405

SCHEMBL2925405

CC(C)c1c(N)cc(N)cc1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.58
TDP1 Q9NUW8 4/20 0.58
KMT2A Q03164 4/20 0.58
MEN1 O00255 3/20 0.58
MAPT P10636 3/20 0.46
THRB P10828 2/20 0.46
RECQL P46063 2/20 0.46
USP2 O75604 1/20 0.46
POLB P06746 1/20 0.46
PKM P14618 1/20 0.46
APEX1 P27695 1/20 0.46
BLM P54132 1/20 0.46
MCL1 Q07820 1/20 0.46
ALDH1A1 P00352 6/20 0.41
CYP3A4 P08684 3/20 0.41
CASP1 P29466 2/20 0.41
CASP7 P55210 2/20 0.41
HSD17B10 Q99714 2/20 0.41
TNF P01375 1/20 0.41
HSPD1 P10809 1/20 0.41

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
SCHEMBL19328233 0.82 KDM4E (0.51) KDM4ETDP1KMT2AMEN1MAPT
SCHEMBL9087874 0.80 MEN1 (0.41) KDM4ETDP1KMT2AMEN1MAPT
SCHEMBL28128870 0.79 KDM4E (0.51) KDM4ETDP1KMT2AMEN1MAPT
SCHEMBL16751774 0.79 KDM4E (0.47) KDM4ETDP1KMT2AMEN1MAPT
SCHEMBL2809942 0.74 KDM4E (1.00) KDM4ETDP1KMT2AMEN1MAPT
SCHEMBL1000705 0.74 KDM4E (0.44) KDM4ETDP1KMT2AMEN1MAPT
SCHEMBL5432823 0.73 MMP2 (0.55) KDM4EKMT2AMAPTALDH1A1CASP7
SCHEMBL9087875 0.73 KDM4E (0.33) KDM4ETDP1KMT2AMEN1ALOX5
SCHEMBL8745088 0.73 CYP3A4 (0.49) KDM4ETDP1KMT2AMEN1MAPT
SCHEMBL999012 0.73 KDM4E (0.63) KDM4ETDP1KMT2AMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6805718-B2 USING AROMATIC AMINE, NAPHTHOL OR AMINONAPHTHALENE AND ENZYME NOVOZYMES A/S (DK) 2004-10-19 US claimed
US-6296672-B1 PEROXIDASE, OXIDOREDUCTASE, LACCASE NOVOZYMES A/S PATENTS (DK) 2001-10-02 US claimed
EP-1303631-B9 BIOTRANSFORMATION OF BIOLOGICALLY ACTIVE COMPOUNDS MADE OF VARIOUS CLASSES OF CHEMICAL SUBSTANCES BY MEANS OF LACCASE AND MANGANESE PEROXIDASE ENZYMES DRITTE PATENTPORTFOLIO BETEILI (DE) 2010-09-08 EP disclosed
EP-1303631-B1 BIOTRANSFORMATION OF BIOLOGICALLY ACTIVE COMPOUNDS MADE OF VARIOUS CLASSES OF CHEMICAL SUBSTANCES BY MEANS OF LACCASE AND MANGANESE PEROXIDASE ENZYMES DRITTE PATENTPORTFOLIO BETEILI (DE) 2010-05-26 EP disclosed
US-6805718-B2 USING AROMATIC AMINE, NAPHTHOL OR AMINONAPHTHALENE AND ENZYME NOVOZYMES A/S (DK) 2004-10-19 US disclosed
EP-1303631-A2 BIOTRANSFORMATION OF BIOLOGICALLY ACTIVE COMPOUNDS MADE OF VARIOUS CLASSES OF CHEMICAL SUBSTANCES BY MEANS OF LACCASE AND MANGANESE PEROXIDASE ENZYMES Schauer, Frieder (DE) 2003-04-23 EP disclosed
WO-2001098518-A2 BIOTRANSFORMATION OF BIOLOGICALLY ACTIVE COMPOUNDS MADE OF VARIOUS CLASSES OF CHEMICAL SUBSTANCES BY MEANS OF LACCASE AND MANGANESE PEROXIDASE ENZYMES GANOMYCIN GMBH (DE) 2001-12-27 WO disclosed
US-6296672-B1 PEROXIDASE, OXIDOREDUCTASE, LACCASE NOVOZYMES A/S PATENTS (DK) 2001-10-02 US disclosed
US-6036729-A DYEING, SOAKING MATERIAL WITH NAPHTHOLS, HYDROGEN PEROXIDE AND ENZYMES OF PEROXIDASE OR OXIDASE NOVO NORDISK A/S (DK) 2000-03-14 US disclosed