SCHEMBL9763097

SCHEMBL9763097

OC(CCCCCOc1ccccc1)Oc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.57
HDAC1 Q13547 3/20 0.52
HDAC2 Q92769 3/20 0.52
HDAC3 O15379 1/20 0.52
HDAC4 P56524 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC11 Q96DB2 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
HDAC9 Q9UKV0 1/20 0.52
HDAC5 Q9UQL6 1/20 0.52
ALDH1A1 P00352 1/20 0.47
RECQL P46063 1/20 0.47
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LTA4H P09960 1/20 0.43
DRD2 P14416 1/20 0.43

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
SCHEMBL9762995 0.93 KCNA3 (0.56) KCNA3HDAC1HDAC2HDAC3HDAC4
SCHEMBL9987936 0.87 KCNA3 (0.52) KCNA3HDAC1HDAC2HDAC3HDAC4
SCHEMBL20608954 0.82 CSNK1E (0.47) ALDH1A1LTA4HDRD2DRD3LMNA
SCHEMBL20608951 0.82 CSNK1E (0.47) ALDH1A1LTA4HDRD2DRD3LMNA
SCHEMBL8205858 0.82 CSNK1E (0.47) ALDH1A1LTA4HDRD2DRD3LMNA
SCHEMBL6377998 0.82 CSNK1E (0.47) ALDH1A1LTA4HDRD2DRD3LMNA
SCHEMBL7593345 0.80 CSNK1E (0.45) ALDH1A1LTA4HDRD2DRD3LMNA
SCHEMBL8311664 0.80 KCNA3 (0.59) KCNA3HDAC1HDAC2HDAC3HDAC4
SCHEMBL17201876 0.80 KCNA3 (0.59) KCNA3HDAC1HDAC2HDAC3HDAC4
SCHEMBL31347353 0.80 L3MBTL1 (0.39) KCNA3HDAC1HDAC2HDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5064929-A Tough, transparent optical films MOBAY CORPORATION (US) 1991-11-12 US disclosed