SCHEMBL8948529

SCHEMBL8948529

Nc1ccc(Cl)c2c1OC1(CC1)C2=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.38
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
APEX1 P27695 1/20 0.31
RECQL P46063 1/20 0.31
RAB9A P51151 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 1/20 0.31
MCL1 Q07820 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
BACE1 P56817 1/20 0.30
CES1 P23141 1/20 0.30

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
SCHEMBL8948579 0.79 ADORA2A (0.40) ADORA2AMEN1NPC1ALDH1A1POLB
SCHEMBL11151353 0.73 MEN1 (0.42) MEN1NPC1ALDH1A1POLBMAPT
SCHEMBL8948488 0.69 PARP1 (0.38) ADORA2AMEN1ALDH1A1POLBMAPT
SCHEMBL8948530 0.67 ADORA2A (0.41) ADORA2AMEN1NPC1ALDH1A1POLB
SCHEMBL8948563 0.66 ADORA2A (0.33) ADORA2A
SCHEMBL11149327 0.63 HTR3A (0.37)
SCHEMBL21603443 0.62 CYP3A4 (0.35) ALDH1A1MAPTTDP1
SCHEMBL10355771 0.61 ADORA2A (0.73) ADORA2AMEN1NPC1ALDH1A1POLB
SCHEMBL10356104 0.61 ADORA2A (0.73) ADORA2AMEN1NPC1ALDH1A1POLB
SCHEMBL10355835 0.61 ADORA2A (0.73) ADORA2AMEN1NPC1ALDH1A1POLB

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-5521147-A HERBICIDES FMC CORPORATION (US) 1996-05-28 US disclosed
WO-1995005079-A1 3-(BENZOFURAN-7-YL)-6-HALOALKYLURACILS FMC CORPORATION (US) 1995-02-23 WO disclosed