SCHEMBL10583181

SCHEMBL10583181

CC(C)CCCC(C)(C)CC(=O)O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.68
CPT2 P23786 1/20 0.68
TDP1 Q9NUW8 1/20 0.68
BHMT Q93088 3/20 0.46
KDM4E B2RXH2 1/20 0.45
HMGCR P04035 1/20 0.41
CHRM1 P11229 1/20 0.41
TBXA2R P21731 1/20 0.41
ADRA1A P35348 1/20 0.41
BLM P54132 1/20 0.41
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39
HIF1A Q16665 1/20 0.39
KDM4C Q9H3R0 2/20 0.37
KDM4A O75164 1/20 0.37
PHF8 Q9UPP1 1/20 0.37
KDM2A Q9Y2K7 1/20 0.37
MEN1 O00255 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL12590728 0.89 FFAR1 (0.58) FFAR1CPT2TDP1BHMTKDM4E
SCHEMBL12094525 0.83 FFAR1 (0.68) FFAR1CPT2TDP1BHMTKDM4E
SCHEMBL186164 0.81 FFAR1 (1.00) FFAR1CPT2TDP1BHMTKDM4E
SCHEMBL1832938 0.81 FFAR1 (1.00) FFAR1CPT2TDP1BHMTKDM4E
SCHEMBL5523390 0.81 FFAR1 (1.00) FFAR1CPT2TDP1BHMTKDM4E
SCHEMBL1834211 0.81 FFAR1 (1.00) FFAR1CPT2TDP1BHMTKDM4E
SCHEMBL8037883 0.81 FFAR1 (1.00) FFAR1CPT2TDP1BHMTKDM4E
SCHEMBL10264387 0.81 FFAR1 (0.65) FFAR1CPT2TDP1BHMTKDM4E
SCHEMBL12094526 0.79 FFAR1 (0.69) FFAR1CPT2TDP1BHMTKDM4E
SCHEMBL1767288 0.79 FFAR1 (0.57) FFAR1CPT2TDP1BHMTKDM4E

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-0307115-A1 Phenol esters IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-03-15 EP disclosed