SCHEMBL8808571

SCHEMBL8808571

CCC(C)(C)C(CC(=O)O)CC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
FFAR3 O14843 1/20 0.31
PGD P52209 1/20 0.31
GPR84 Q9NQS5 4/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
HMGCR P04035 1/20 0.30
CHRM1 P11229 1/20 0.30
TBXA2R P21731 1/20 0.30
ADRA1A P35348 1/20 0.30

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
SCHEMBL13927844 0.79 TSHR (0.33)
SCHEMBL11291278 0.78 FOLH1 (0.42) FFAR3GPR84
SCHEMBL22870371 0.76 GPR84 (0.44) GPR84
SCHEMBL805129 0.72 PHF8 (0.34)
SCHEMBL5150731 0.71 SLC22A6 (0.36) SLC22A6TDP1FFAR3PGDGPR84
SCHEMBL25069480 0.71 FOLH1 (0.33)
SCHEMBL13359873 0.70 CA2 (0.31) TDP1CHRM1ADRA1A
SCHEMBL3884302 0.70 TDP1 (0.39) SLC22A6TDP1FFAR3PGDGPR84
SCHEMBL16281726 0.70 CA2 (0.31) TDP1CHRM1ADRA1A
SCHEMBL28194885 0.70 SLC22A6 (0.35) SLC22A6TDP1FFAR3PGDGPR84

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-1589377-B1 Patterning process and resist overcoat material SHINETSU CHEMICAL CO (JP) 2012-05-23 EP disclosed