SCHEMBL7112355

SCHEMBL7112355

CC(C/C=C/c1ccccc1)C(=O)C(C)C/C=C/c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.59
PAM P19021 1/20 0.53
GRIK1 P39086 3/20 0.51
GRIK2 Q13002 3/20 0.51
TDP1 Q9NUW8 2/20 0.46
GLA P06280 1/20 0.46
MAOB P27338 1/20 0.45
CTSC P53634 1/20 0.45
HDAC3 O15379 1/20 0.44
TNKS O95271 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HCAR2 Q8TDS4 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
TNKS2 Q9H2K2 1/20 0.44
HDAC6 Q9UBN7 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
SCHEMBL7112358 1.00 HTR2A (0.59) HTR2APAMGRIK1GRIK2TDP1
SCHEMBL1767325 0.89 HTR2A (0.59) HTR2APAMGRIK1GRIK2TDP1
SCHEMBL8826027 0.89 HTR2A (0.59) HTR2APAMGRIK1GRIK2TDP1
SCHEMBL1716478 0.89 HTR2A (0.59) HTR2APAMGRIK1GRIK2TDP1
SCHEMBL8826020 0.89 HTR2A (0.59) HTR2APAMGRIK1GRIK2TDP1
SCHEMBL27820312 0.87 HTR2A (0.58) HTR2APAMGRIK1GRIK2TDP1
SCHEMBL13235939 0.87 HTR2A (0.58) HTR2APAMGRIK1GRIK2TDP1
SCHEMBL10990319 0.86 HTR2A (0.56) HTR2APAMGRIK1GRIK2TDP1
SCHEMBL27947171 0.83 HTR2A (0.53) HTR2APAMGRIK1GRIK2TDP1
SCHEMBL10990322 0.81 HTR2A (0.59) HTR2APAMGRIK1GRIK2CTSC

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
EP-0794218-B1 Polycarbonate resin composition stabilized against radiation MITSUBISHI ENG PLASTICS CORP (JP) 2003-10-15 EP disclosed
US-6040367-A EXCELLENT RESISTANCE TO AN IONIZING RADIATION, IN WHICH HETEROCYCLIC COMPOUND CONTAINING OXYMETHYLENE UNITS MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 2000-03-21 US disclosed
US-5948838-A 0.01 TO 5 PARTS BY WEIGHT OF A COMPOUND CONTAINING OXYMETHYLENE UNIT MITSUBISHI ENGINEERING-PLASTICS CORP. (JP) 1999-09-07 US disclosed
EP-0794218-A2 Polycarbonate resin composition stabilized against radiation MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 1997-09-10 EP disclosed