SCHEMBL7570690

SCHEMBL7570690

O=C(O)c1cccc2cc3ccc(Br)cc3nc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
SORT1 Q99523 4/20 0.44
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
RXFP1 Q9HBX9 3/20 0.43
DHODH Q02127 1/20 0.41
KDM4E B2RXH2 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
HTT P42858 1/20 0.40
GLA P06280 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
METAP2 P50579 1/20 0.39
PPARG P37231 2/20 0.39
NCOR2 Q9Y618 2/20 0.39
ESR1 P03372 1/20 0.39
PLA2G1B P04054 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL7569493 0.88 ALDH1A1 (0.49) ALDH1A1SORT1MEN1KMT2ARXFP1
SCHEMBL27418513 0.87 PARP1 (0.51) ALDH1A1RXFP1KDM4E
SCHEMBL7570787 0.83 ABCG2 (0.49) ALDH1A1KMT2AKDM4ECYP1A2HTT
SCHEMBL902623 0.82 ALDH1A1 (0.66) ALDH1A1MEN1KMT2ADHODHKDM4E
SCHEMBL14304530 0.82 ALDH1A1 (0.49) ALDH1A1MEN1KMT2ADHODHKDM4E
SCHEMBL7567042 0.82 ALDH1A1 (0.49) ALDH1A1SORT1MEN1KMT2APOLB
SCHEMBL7568155 0.82 ALDH1A1 (0.49) ALDH1A1MEN1KMT2ARXFP1DHODH
SCHEMBL1210330 0.79 ALDH1A1 (0.71) ALDH1A1SORT1MEN1KMT2ARXFP1
SCHEMBL7572756 0.78 ALDH1A1 (0.45) ALDH1A1SORT1MEN1KMT2ADHODH
SCHEMBL7568147 0.78 KDM4E (0.48) ALDH1A1MEN1KMT2AKDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1116285-C Bis(acridinecarboxamide) and Bis(phenazinecarboxamide) as antitumour agents XENOVA LTD (GB) 2003-07-30 CN disclosed
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
CN-1240430-A Bis(acridinecarboxamide) and Bis(phenazinecarboxamide) as antitumour agents XENOVA LTD (GB) 2000-01-05 CN 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