SCHEMBL9768035

SCHEMBL9768035

O=C(CNc1ccccc1-c1ccccc1)c1ccc(O)c(O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.50
ALDH1A1 P00352 4/20 0.50
HPGD P15428 2/20 0.50
ALPG P10696 7/20 0.49
ALPL P05186 6/20 0.49
PLAA Q9Y263 3/20 0.49
TERT O14746 1/20 0.48
TOP1 P11387 1/20 0.48
RAB9A P51151 2/20 0.46
AGTR1 P30556 2/20 0.46
ESR2 Q92731 2/20 0.43
ESR1 P03372 1/20 0.43
LMNA P02545 2/20 0.42
GAA P10253 4/20 0.42
POLB P06746 2/20 0.42
MAPT P10636 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
HSP90AA1 P07900 1/20 0.42
HSP90AB1 P08238 1/20 0.42
ALPI P09923 1/20 0.42

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
SCHEMBL9768330 0.80 ALPL (0.51) KDM4EALDH1A1ALPGALPLPLAA
SCHEMBL9768152 0.80 ALPL (0.51) KDM4EALDH1A1ALPGALPLPLAA
SCHEMBL9768029 0.80 ALPL (0.56) KDM4EALDH1A1ALPGALPLPLAA
SCHEMBL9768281 0.80 ALPL (0.51) KDM4EALDH1A1ALPGALPLPLAA
SCHEMBL9768260 0.79 ERCC1 (0.60) KDM4EALDH1A1HPGDALPGALPL
SCHEMBL9768231 0.78 ALPL (0.52) KDM4EALDH1A1HPGDALPGALPL
SCHEMBL9768032 0.77 TTR (0.49) KDM4EALPGALPLPLAATERT
SCHEMBL9768242 0.77 ALPG (0.50) KDM4EALDH1A1HPGDALPGALPL
SCHEMBL8165269 0.75 ALDH1A1 (0.64) KDM4EALDH1A1HPGDRAB9ALMNA
SCHEMBL9768012 0.72 ALPG (0.50) KDM4EALDH1A1ALPGALPLPLAA

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