SCHEMBL8977481

SCHEMBL8977481

C=C(CCCC(C)CCCO)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.37
ACE2 Q9BYF1 1/20 0.35
PTPN1 P18031 3/20 0.33
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
MAPT P10636 1/20 0.33
TET2 Q6N021 4/20 0.32
TET3 O43151 1/20 0.32
TET1 Q8NFU7 1/20 0.32
TBXAS1 P24557 2/20 0.32

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
SCHEMBL1683325 0.92 BLM (0.37) BLMACE2PTPN1HDAC3HDAC4
SCHEMBL8977476 0.92 BLM (0.37) BLMACE2PTPN1CAMK2AHDAC3
SCHEMBL7563427 0.85 BLM (0.55) BLMACE2PTPN1HDAC3HDAC4
SCHEMBL11614364 0.85 BLM (0.55) BLMACE2PTPN1HDAC3HDAC4
SCHEMBL16318792 0.85 ACE2 (0.47) BLMACE2PTPN1HDAC11MAPT
SCHEMBL7631881 0.85 ACE2 (0.43) BLMACE2PTPN1HDAC3HDAC4
SCHEMBL11614360 0.85 BLM (0.55) BLMACE2PTPN1HDAC3HDAC4
SCHEMBL8141493 0.82 TET2 (0.42) BLMACE2HDAC3HDAC4HDAC1
SCHEMBL4929618 0.82 ACE2 (0.36) BLMACE2MAPTTET2TET3
SCHEMBL867496 0.81 ACE2 (0.58) ACE2PTPN1HDAC11MAPTGPR84

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-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