SCHEMBL7715523

SCHEMBL7715523

COc1ccc2cc(C)[nH]c(=O)c2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.58
HSD17B10 Q99714 2/20 0.58
LMNA P02545 2/20 0.58
ALDH1A1 P00352 5/20 0.57
HPGD P15428 4/20 0.57
GAA P10253 1/20 0.56
AXL P30530 1/20 0.54
TYMS P04818 1/20 0.48
PARP15 Q460N3 1/20 0.48
PARP14 Q460N5 1/20 0.48
PARP10 Q53GL7 1/20 0.48
TNKS2 Q9H2K2 1/20 0.48
PARP2 Q9UGN5 1/20 0.48
MAPT P10636 2/20 0.47
MEN1 O00255 1/20 0.47
TSHR P16473 1/20 0.47
GFER P55789 1/20 0.47
KMT2A Q03164 1/20 0.47
TUBB4A P04350 1/20 0.45
TUBB P07437 1/20 0.45

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
SCHEMBL741856 0.86 AXL (0.59) KDM4EHSD17B10LMNAALDH1A1HPGD
SCHEMBL2432923 0.79 KDM4E (0.60) KDM4EHSD17B10LMNAALDH1A1HPGD
SCHEMBL824649 0.78 KDM4E (0.63) KDM4EHSD17B10LMNAALDH1A1GAA
SCHEMBL19953423 0.78 LOXL2 (0.59) KDM4EHSD17B10LMNAALDH1A1HPGD
SCHEMBL29853659 0.76 PARP15 (0.58) KDM4EHSD17B10LMNAALDH1A1HPGD
SCHEMBL26785799 0.76 PARP15 (0.58) KDM4EHSD17B10LMNAALDH1A1HPGD
SCHEMBL1719777 0.75 GAA (0.59) KDM4ELMNAHPGDGAATYMS
SCHEMBL13118309 0.75 KDM4E (0.59) KDM4EALDH1A1HPGDGAATYMS
SCHEMBL29914786 0.75 KDM4E (0.59) KDM4EGAATYMSTNKS2TUBB4A
SCHEMBL13118310 0.75 KDM4E (0.59) KDM4EALDH1A1HPGDGAATYMS

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-6403608-B1 ANTIINFLAMMATORY AND IMMUNE DISORDERS CELLTECH R&D, LTD. (GB) 2002-06-11 US disclosed