SCHEMBL9225568

SCHEMBL9225568

CCOC(=O)C1=C(C(F)(F)F)OCC1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 2/20 0.38
HDAC6 Q9UBN7 2/20 0.38
ADORA2B P29275 2/20 0.38
KDM4E B2RXH2 5/20 0.37
LMNA P02545 3/20 0.37
ALDH1A1 P00352 6/20 0.35
GAA P10253 2/20 0.35
POLB P06746 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
MTOR P42345 1/20 0.35
RAB9A P51151 1/20 0.35
TSHR P16473 3/20 0.34
HPGD P15428 2/20 0.34
HSD17B10 Q99714 2/20 0.34
TP53 P04637 2/20 0.34
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL24376263 0.69 KDM4E (0.37) HDAC4HDAC6ADORA2BKDM4ELMNA
SCHEMBL24376720 0.68 KDM4E (0.36) HDAC4HDAC6ADORA2BKDM4ELMNA
SCHEMBL3760345 0.67 HDAC4 (0.36) HDAC4HDAC6ADORA2BKDM4ELMNA
SCHEMBL31190876 0.66 KDM4E (0.45) KDM4ELMNAALDH1A1GAAPOLB
SCHEMBL9726284 0.64 KDM4E (0.62) ADORA2BKDM4ELMNAALDH1A1GAA
SCHEMBL9726347 0.62 ADORA2B (0.48) ADORA2BKDM4ELMNAALDH1A1GAA
SCHEMBL18501088 0.62 HDAC4 (0.38) HDAC4HDAC6ADORA2BKDM4ELMNA
SCHEMBL4739182 0.62 HDAC4 (0.41) HDAC4HDAC6ADORA2BKDM4ELMNA
SCHEMBL9305990 0.62 LMNA (0.43) KDM4ELMNAALDH1A1GAAPOLB
SCHEMBL4915483 0.62

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-5405865-A Pyrethroid esters ROUSSEL-UCLAF (FR) 1995-04-11 US disclosed