SCHEMBL6957940

SCHEMBL6957940

[CH2]OC(=O)CCCCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.61
RXFP1 Q9HBX9 1/20 0.61
HDAC1 Q13547 4/20 0.55
HDAC2 Q92769 2/20 0.55
HDAC3 O15379 1/20 0.55
MAPK1 P28482 1/20 0.55
ADRA1A P35348 1/20 0.55
HDAC4 P56524 1/20 0.55
SLC6A3 Q01959 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
HDAC7 Q8WUI4 1/20 0.55
HDAC10 Q969S8 1/20 0.55
HDAC11 Q96DB2 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
HDAC9 Q9UKV0 1/20 0.55
HDAC5 Q9UQL6 1/20 0.55
ALOX5 P09917 3/20 0.54
FAAH O00519 3/20 0.53
CES1 P23141 3/20 0.53

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
SCHEMBL6960094 0.94 HDAC1 (0.62) MAPTRXFP1HDAC1HDAC2HDAC3
SCHEMBL2903287 0.86 TDP1 (0.68) MAPTRXFP1HDAC1HDAC2HDAC3
SCHEMBL8790943 0.85 MAPT (0.66) MAPTRXFP1HDAC1HDAC2HDAC3
SCHEMBL7651575 0.85 MAPT (0.66) MAPTRXFP1HDAC1HDAC2HDAC3
SCHEMBL13498527 0.83 MAPT (0.63) MAPTRXFP1HDAC1HDAC2HDAC3
SCHEMBL7655514 0.83 MAPT (0.69) MAPTRXFP1HDAC1HDAC2HDAC3
SCHEMBL11578613 0.83 MAPT (0.69) MAPTRXFP1HDAC1HDAC2HDAC3
SCHEMBL26927562 0.83 MAPT (0.63) MAPTRXFP1HDAC1HDAC2HDAC3
SCHEMBL10623470 0.83 MAPT (0.69) MAPTRXFP1HDAC1HDAC2HDAC3
SCHEMBL2774750 0.82 MAPT (0.58) MAPTRXFP1HDAC1HDAC2HDAC3

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
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed