SCHEMBL31558046

SCHEMBL31558046

CC(C)CCCCC(O)CO

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.48
LMNA P02545 4/20 0.46
TSHR P16473 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TDP1 Q9NUW8 1/20 0.40
USP2 O75604 1/20 0.39
CYP3A4 P08684 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ACACB O00763 1/20 0.35
ACACA Q13085 1/20 0.35
TRPV1 Q8NER1 1/20 0.35
TRPA1 O75762 1/20 0.35
KDM4C Q9H3R0 2/20 0.34
KDM4A O75164 1/20 0.34
PHF8 Q9UPP1 1/20 0.34
KDM2A Q9Y2K7 1/20 0.34
PTPN1 P18031 1/20 0.33
BLM P54132 1/20 0.33
GPR84 Q9NQS5 1/20 0.32
SPHK1 Q9NYA1 1/20 0.32

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
SCHEMBL19206303 0.97 THRB (0.46) THRBLMNATSHRALDH1A1TDP1
SCHEMBL9462521 0.97 THRB (0.46) THRBLMNATSHRALDH1A1TDP1
SCHEMBL29602471 0.97 THRB (0.46) THRBLMNATSHRALDH1A1TDP1
SCHEMBL9462430 0.97 THRB (0.46) THRBLMNATSHRALDH1A1TDP1
SCHEMBL9462115 0.97 THRB (0.46) THRBLMNATSHRALDH1A1TDP1
SCHEMBL9462317 0.97 THRB (0.46) THRBLMNATSHRALDH1A1TDP1
SCHEMBL7752553 0.97 THRB (0.46) THRBLMNATSHRALDH1A1TDP1
SCHEMBL4196461 0.94 THRB (0.48) THRBLMNATSHRALDH1A1TDP1
SCHEMBL28900807 0.89 THRB (0.44) THRBLMNATSHRALDH1A1USP2
SCHEMBL28900806 0.85 THRB (0.40) THRBLMNATSHRALDH1A1TDP1

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
CN-119764555-A Annular ether electrolyte for alkali metal battery, preparation method of annular ether electrolyte and alkali metal battery 池州聚石化学有限公司 2025-04-04 CN disclosed