SCHEMBL7570787

SCHEMBL7570787

COC(=O)c1cccc2cc3ccc(Br)cc3nc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 1/20 0.49
GAA P10253 3/20 0.47
KDM4E B2RXH2 1/20 0.47
KMT2A Q03164 1/20 0.47
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MAPT P10636 2/20 0.43
CYP1A2 P05177 1/20 0.43
RECQL P46063 1/20 0.43
SLC6A3 Q01959 2/20 0.43
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
IRAK4 Q9NWZ3 1/20 0.41
NR4A2 P43354 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALDH1A1 P00352 1/20 0.40
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40

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
SCHEMBL7030506 0.84 KDM4E (0.56) ABCG2GAAKDM4EKMT2AATM
SCHEMBL2442682 0.84 KDM4E (0.47) ABCG2GAAKDM4EKMT2AATM
SCHEMBL7570690 0.83 ALDH1A1 (0.49) KDM4EKMT2AL3MBTL1MAPTCYP1A2
SCHEMBL27418513 0.82 PARP1 (0.51) GAAKDM4EALDH1A1
SCHEMBL7564071 0.81 CFTR (0.49) GAAKDM4EKMT2AATMMAPT
SCHEMBL1668640 0.77 NR4A2 (0.54) ABCG2GAAKDM4EKMT2AATM
SCHEMBL31272725 0.76 L3MBTL1 (0.53) ABCG2GAAKDM4EKMT2AL3MBTL1
SCHEMBL31229584 0.76 L3MBTL1 (0.53) ABCG2GAAKDM4EKMT2AL3MBTL1
SCHEMBL22743606 0.76 L3MBTL1 (0.50) ABCG2GAAKDM4EL3MBTL1MAPT
SCHEMBL9125289 0.76 PSMD14 (0.50) GAAKDM4EKMT2AATMMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934278-B1 BIS(ACRIDINECARBOXAMIDE) AND BIS(PHENAZINECARBOXAMIDE) AS ANTITUMOUR AGENTS XENOVA LTD (GB) 2002-09-04 EP disclosed
US-6114332-A BACTERICIDES XENOVA LIMITED (GB) 2000-09-05 US disclosed
EP-0934278-A1 BIS(ACRIDINECARBOXAMIDE) AND BIS(PHENAZINECARBOXAMIDE) AS ANTITUMOUR AGENTS XENOVA LIMITED (GB) 1999-08-11 EP disclosed
WO-1998017650-A1 BIS(ACRIDINECARBOXAMIDE) AND BIS(PHENAZINECARBOXAMIDE) AS ANTITUMOUR AGENTS XENOVA LIMITED (GB) 1998-04-30 WO disclosed