SCHEMBL27417840

SCHEMBL27417840

CC(=O)Oc1cccc2cc3cc(C)cc(C)c3nc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 2/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
APEX1 P27695 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
PDE10A Q9Y233 2/20 0.39
ACHE P22303 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
SCHEMBL7466188 0.78 PARP1 (0.56) ALDH1A1KMT2AGAAKDM4EPOLB
SCHEMBL27450148 0.77 ALDH1A1 (0.44) ALDH1A1KMT2AGAAKDM4EPOLB
SCHEMBL7572680 0.75 PARP1 (0.46) ALDH1A1KMT2AGAAKDM4EPOLB
SCHEMBL7568945 0.75 PARP1 (0.43) ALDH1A1KMT2AGAAKDM4EPOLB
SCHEMBL27417062 0.74 PARP1 (0.62) ALDH1A1GAAKDM4ECYP3A4PARP1
SCHEMBL15532332 0.73 KMT2A (0.51) ALDH1A1KMT2AGAAKDM4EPOLB
SCHEMBL28555834 0.73 CYP1A2 (0.60) ALDH1A1KMT2AGAAKDM4EPOLB
SCHEMBL27887074 0.72 PSMD14 (0.51) ALDH1A1KMT2AKDM4EPOLBMAPT
SCHEMBL27417841 0.72 TDP1 (0.43) ALDH1A1KMT2AKDM4EPOLBTDP1
SCHEMBL27450576 0.71 KMT2A (0.42) ALDH1A1KMT2AGAAKDM4EPOLB

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