SCHEMBL8601309

SCHEMBL8601309

COC[C@H]1CC[C@H](COc2ccc(OC(=O)c3ccccc3)cc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 5/20 0.51
PARP15 Q460N3 4/20 0.51
PARP2 Q9UGN5 2/20 0.51
MAPT P10636 5/20 0.48
KMT2A Q03164 5/20 0.48
TDP1 Q9NUW8 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ALDH1A1 P00352 1/20 0.48
PKM P14618 1/20 0.48
NR1H4 Q96RI1 1/20 0.47
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
GPR88 Q9GZN0 1/20 0.45
MEN1 O00255 2/20 0.44

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
SCHEMBL8601311 1.00 PARP10 (0.51) PARP10PARP15PARP2MAPTKMT2A
SCHEMBL14458250 0.80 CARM1 (0.58) KMT2ATDP1ALDH1A1NPC1MEN1
SCHEMBL11385381 0.80 PARP10 (0.50) PARP10PARP15PARP2MAPTKMT2A
SCHEMBL18873117 0.79 POLB (0.47) PARP10PARP15PARP2MAPTKMT2A
SCHEMBL14033187 0.78 PARP15 (0.66) PARP10PARP15PARP2KMT2AL3MBTL1
SCHEMBL927657 0.78 PARP15 (0.66) PARP10PARP15PARP2MAPTKMT2A
SCHEMBL816455 0.78 PARP15 (0.50) PARP10PARP15PARP2TDP1
SCHEMBL815784 0.78 PARP15 (0.43) PARP10PARP15PARP2MAPTKMT2A
SCHEMBL9291511 0.77 PARP15 (0.50) PARP10PARP15PARP2MAPTKMT2A
SCHEMBL8583295 0.76 TDP1 (0.63) PARP10MAPTKMT2ATDP1L3MBTL1

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
US-5830542-A Reflective guest-host liquid-crystal display SONY CORPORATION (JP) 1998-11-03 US claimed
US-5830542-A Reflective guest-host liquid-crystal display SONY CORPORATION (JP) 1998-11-03 US disclosed