SCHEMBL8569587

SCHEMBL8569587

ClC(Cl)(Cl)Cc1ccco1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.41
CHRM2 P08172 1/20 0.39
ALDH1A1 P00352 5/20 0.38
USP2 O75604 2/20 0.37
HPGD P15428 2/20 0.37
ALOX5 P09917 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX15 P16050 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KMT2A Q03164 5/20 0.37
MEN1 O00255 4/20 0.37
MAPT P10636 3/20 0.37
KDM4E B2RXH2 2/20 0.37
TSHR P16473 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.35

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
SCHEMBL8570960 0.78 CHRM2 (0.45) GAACHRM2ALDH1A1USP2HPGD
SCHEMBL8570516 0.76 GAA (0.41) GAACHRM2ALDH1A1USP2HPGD
SCHEMBL275345 0.76 ALDH1A1 (0.44) GAACHRM2ALDH1A1USP2HPGD
SCHEMBL8323969 0.73 SLC6A2 (0.45) GAACHRM2ALDH1A1ALOX5CYP3A4
SCHEMBL12812535 0.73 ALDH1A1 (0.46) GAACHRM2ALDH1A1USP2ALOX5
SCHEMBL6584208 0.72
SCHEMBL281641 0.72
Furfuryl Alcohol SCHEMBL28270671 0.71
SCHEMBL30983118 0.71 ALDH1A1 (0.40) GAACHRM2ALDH1A1ALOX5TDP1
SCHEMBL28301847 0.71 ALDH1A1 (0.47) GAACHRM2ALDH1A1USP2HPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5744678-A NICKEL COMPOUND, ORGANOPHOSPHORUS COMPOUND, ORGANOALUMINUM COMPOUND, CARBON-HALOGEN COMPOUNDS; CATALYST SELECTIVITY NIPPON OIL CO., LTD. (JP) 1998-04-28 US disclosed
US-5728641-A Catalyst component for the polymerization of olefins NIPPON OIL COMPANY, LIMITED (JP) 1998-03-17 US disclosed
EP-0758563-A1 OLEFIN OLIGOMERIZATION CATALYST AND PROCESS FOR THE PREPARATION OF OLEFIN OLIGOMER USING IT NIPPON OIL COMPANY, LTD. (JP) 1997-02-19 EP disclosed
EP-0587440-A2 Catalyst component for the polymerisation of olefins and process for preparing olefin polymers using same NIPPON OIL COMPANY, LIMITED (JP) 1994-03-16 EP disclosed