SCHEMBL8977476

SCHEMBL8977476

C=C(CCC(C)CCCO)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.37
MAPT P10636 1/20 0.36
ACE2 Q9BYF1 1/20 0.35
CAMK2A Q9UQM7 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
TET2 Q6N021 4/20 0.32
TET3 O43151 1/20 0.32
TET1 Q8NFU7 1/20 0.32
GRIK1 P39086 1/20 0.31
GRIK2 Q13002 1/20 0.31

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
SCHEMBL8977481 0.92 BLM (0.37) BLMMAPTACE2CAMK2AHDAC3
SCHEMBL28927338 0.85 BLM (0.55) BLMMAPTACE2HDAC3HDAC4
SCHEMBL1683325 0.85 BLM (0.37) BLMMAPTACE2HDAC3HDAC4
SCHEMBL950316 0.85 ACE2 (0.47) BLMMAPTACE2HDAC11GPR84
SCHEMBL3289423 0.83 ACE2 (0.55) MAPTACE2GPR84FFAR1FFAR4
SCHEMBL866424 0.83 BLM (0.48) BLMMAPTACE2HDAC3HDAC4
SCHEMBL3880567 0.82 TSHR (0.41) TET2TET3TET1GRIK1GRIK2
SCHEMBL3284960 0.81 ACE2 (0.58) MAPTACE2HDAC11GPR84FFAR1
SCHEMBL2695646 0.81 ACE2 (0.58) MAPTACE2HDAC11GPR84FFAR1
SCHEMBL16442960 0.81 ACE2 (0.58) MAPTACE2HDAC11GPR84FFAR1

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-0376021-B1 Styrene-based resin composite material and use thereof IDEMITSU PETROCHEMICAL CO (JP) 1996-04-24 EP disclosed
US-5273830-A Magnetic recording medium comprising a syndiotactic styrene-based polymer substrate, a magnetic layer and a backcoat lubricating layer each layer containing a curable phosphazine compound IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1993-12-28 US disclosed
US-5082717-A Lubricating layer of a curable phosphazene compound IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1992-01-21 US disclosed
EP-0376021-A2 Styrene-based resin composite material and use thereof IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1990-07-04 EP disclosed