SCHEMBL851207

SCHEMBL851207

Cc1cccc(C(=O)c2cc(C(=O)c3ccccc3)cc(C(=O)c3ccccc3)c2)c1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.72
TDP1 Q9NUW8 1/20 0.72
L3MBTL1 Q9Y468 1/20 0.72
POLB P06746 2/20 0.66
CNR2 P34972 4/20 0.63
CNR1 P21554 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.59
PARP1 P09874 1/20 0.57
ALDH1A1 P00352 1/20 0.56
MAPK13 O15264 1/20 0.55
MAPK12 P53778 1/20 0.55
MAPK11 Q15759 1/20 0.55
MAPK14 Q16539 1/20 0.55
PBRM1 Q86U86 1/20 0.55
VNN1 O95497 1/20 0.54
HDAC8 Q9BY41 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
KCNK3 O14649 1/20 0.53

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
SCHEMBL81347 0.96 ATM (0.71) ATMTDP1L3MBTL1POLBCNR2
SCHEMBL29658753 0.96 ATM (0.71) ATMTDP1L3MBTL1POLBCNR2
SCHEMBL15264066 0.92 PARP1 (0.65) ATMTDP1L3MBTL1POLBCNR2
SCHEMBL22175283 0.90 PARP1 (0.59) ATMTDP1L3MBTL1POLBCNR2
Benzophenone SCHEMBL11756762 0.90 ATM (0.67) ATMTDP1L3MBTL1POLBCNR2
SCHEMBL15686210 0.90 ATM (0.67) ATMTDP1L3MBTL1POLBCNR2
SCHEMBL822041 0.90 PARP1 (0.63) ATMTDP1L3MBTL1POLBCNR2
SCHEMBL186545 0.89 PARP1 (0.68) ATMTDP1L3MBTL1POLBCNR2
SCHEMBL29503529 0.89 PARP1 (0.68) ATMTDP1L3MBTL1POLBCNR2
SCHEMBL12792079 0.88 CNR2 (0.57) ATMTDP1L3MBTL1POLBCNR2

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
US-8143465-B2 Soluble branched triaroylbenzene-based polymer and its synthetic method THE HONG KONG UNIVERSITY OF SCIENCE & TECHNOLOGY (CN) 2012-03-27 US disclosed