SCHEMBL9768231

SCHEMBL9768231

O=C(CNc1cccc2ccccc12)c1ccc(O)c(O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPL P05186 4/20 0.52
ALPG P10696 4/20 0.52
PLAA Q9Y263 1/20 0.52
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
TERT O14746 1/20 0.48
TOP1 P11387 1/20 0.48
KDM4E B2RXH2 7/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
MAPT P10636 4/20 0.46
MCL1 Q07820 1/20 0.46
CA12 O43570 3/20 0.46
CA9 Q16790 3/20 0.46
CA4 P22748 2/20 0.46
CA7 P43166 2/20 0.46
CA14 Q9ULX7 2/20 0.46
H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 P62805 1/20 0.44
EP300 Q09472 1/20 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
SCHEMBL9768281 0.80 ALPL (0.51) ALPLALPGPLAATERTTOP1
SCHEMBL9768152 0.80 ALPL (0.51) ALPLALPGPLAATERTTOP1
SCHEMBL9768330 0.80 ALPL (0.51) ALPLALPGPLAATERTTOP1
SCHEMBL9768029 0.80 ALPL (0.56) ALPLALPGPLAATERTTOP1
SCHEMBL9768035 0.78 KDM4E (0.50) ALPLALPGPLAATERTTOP1
SCHEMBL9768242 0.77 ALPG (0.50) ALPLALPGPLAATERTTOP1
SCHEMBL9768260 0.76 ERCC1 (0.60) ALPLALPGPLAATERTTOP1
SCHEMBL9768234 0.76 INSR (0.57) ALPLALPGPLAAKDM4EMEN1
SCHEMBL9768032 0.75 TTR (0.49) ALPLALPGPLAATERTTOP1
SCHEMBL412396 0.74 PARP1 (0.58) KDM4EMEN1KMT2ATDP1MAPT

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-5047592-A Selective hydrogenolysis process ETHYL CORPORATION (US) 1991-09-10 US disclosed