SCHEMBL8846321

SCHEMBL8846321

COC(=O)C(Cc1ccccc1Br)C(=O)OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
PPARG P37231 2/20 0.44
PPARA Q07869 2/20 0.44
KMT2A Q03164 4/20 0.43
MAPT P10636 1/20 0.43
PKM P14618 1/20 0.43
RAB9A P51151 1/20 0.43
MEN1 O00255 1/20 0.43
PPARD Q03181 1/20 0.43
EPHX2 P34913 1/20 0.42
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
TSHR P16473 1/20 0.42
RIPK1 Q13546 1/20 0.42
PTPRB P23467 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
ALDH1A1 P00352 2/20 0.40
RECQL P46063 1/20 0.40
HPGD P15428 1/20 0.40
ANPEP P15144 1/20 0.40

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
SCHEMBL27688896 0.90 CTSS (0.50) POLBPPARGPPARAKMT2AMAPT
SCHEMBL2386210 0.85 MMP8 (0.51) POLBPPARGPPARAKMT2AMAPT
SCHEMBL30523454 0.83 POLB (0.43) POLBPPARGPPARAKMT2AMAPT
SCHEMBL2152880 0.83 POLB (0.43) POLBPPARGPPARAKMT2AMAPT
SCHEMBL16271273 0.83 POLB (0.43) POLBPPARGPPARAKMT2AMAPT
SCHEMBL2152877 0.83 POLB (0.43) POLBPPARGPPARAKMT2AMAPT
SCHEMBL12427788 0.83 TAAR1 (0.46) POLBKMT2AMAPTPKMRAB9A
Hydrochloric Acid SCHEMBL16267941 0.82 IDO1 (0.42) POLBPPARGPPARAKMT2AMAPT
Hydrochloric Acid SCHEMBL32676717 0.82 IDO1 (0.42) POLBPPARGPPARAKMT2AMAPT
Hydrochloric Acid SCHEMBL21489555 0.82 IDO1 (0.42) POLBPPARGPPARAKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0693502-B1 Catalyst component for the polymerization of alpha-olefins and a process for preparing alpha-olefin polymers with use of same MITSUBISHI CHEM CORP (JP) 1997-11-05 EP disclosed
US-5594081-A METALLOCENES MITSUBISHI CHEMICAL CORPORATION (JP) 1997-01-14 US disclosed
EP-0693502-A1 Catalyst component for the polymerization of alpha-olefins and a process for preparing alpha-olefin polymers with use of same MITSUBISHI CHEMICAL CORPORATION (JP) 1996-01-24 EP disclosed