SCHEMBL24612929

SCHEMBL24612929

CCCCCOC(C)(C)CC(O)COC(C)(C)CCCCC

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.38
HTT P42858 1/20 0.37
LPAR5 Q9H1C0 1/20 0.33
VDR P11473 1/20 0.31
SPHK1 Q9NYA1 1/20 0.31
PLA2G2C Q5R387 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
CNR2 P34972 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
SCHEMBL10420136 0.80 USP2 (0.50) USP2HTTVDRSPHK1PLA2G2C
SCHEMBL23095082 0.79 USP2 (0.50) USP2HTTLPAR5SPHK1PLA2G2C
SCHEMBL28775036 0.78 THRB (0.38) HTT
SCHEMBL7096757 0.78 USP2 (0.53) USP2HTTVDRSPHK1PLA2G2C
SCHEMBL10420978 0.78 USP2 (0.53) USP2HTTVDRSPHK1PLA2G2C
Ammonia Solution, Strong SCHEMBL28750734 0.77 THRB (0.36) HTT
SCHEMBL13825811 0.76 ADRB2 (0.36) CYP3A4
SCHEMBL27850922 0.74 ADRB2 (0.35) CYP3A4
SCHEMBL19336150 0.74 USP2 (0.39) USP2HTTSPHK1
SCHEMBL23711161 0.74 LMNA (0.50) USP2HTT

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-4026860-A1 BIO-ELECTRODE COMPOSITION, BIO-ELECTRODE, AND METHOD FOR MANUFACTURING BIO-ELECTRODE Shin-Etsu Chemical Co., Ltd. (JP) 2022-07-13 EP disclosed