SCHEMBL28878348

SCHEMBL28878348

CCCc1cc(C(C)(C)C)c(-c2ccc(O)cc2)c(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 1/20 0.40
GAA P10253 2/20 0.39
KMT2A Q03164 1/20 0.39
USP7 Q93009 1/20 0.39
LMNA P02545 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TYR P14679 2/20 0.39
NR1I2 O75469 1/20 0.39
CYP2C9 P11712 1/20 0.39
MIF P14174 1/20 0.39
ALOX15 P16050 1/20 0.39
HTT P42858 1/20 0.39
NFE2L2 Q16236 1/20 0.39
ESR1 P03372 6/20 0.38
ESR2 Q92731 3/20 0.38
ADRA2A P08913 2/20 0.37
ADORA3 P0DMS8 2/20 0.37
TACR2 P21452 2/20 0.37
SLC6A2 P23975 2/20 0.37

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
SCHEMBL28071613 0.90 PTGS2 (0.46) HSPA5GAAKMT2ALMNAALDH1A1
SCHEMBL28145382 0.88 HSPA5 (0.51) HSPA5GAAKMT2AUSP7LMNA
SCHEMBL28835105 0.88 PTGS2 (0.56) KMT2ALMNAALDH1A1HSD17B10TYR
SCHEMBL28075203 0.83 ALDH1A1 (0.41) HSPA5GAAKMT2ALMNAALDH1A1
SCHEMBL27953714 0.81 RXRA (0.51) GAAKMT2ALMNAALDH1A1HTT
SCHEMBL27770126 0.81 CNR1 (0.46) HSPA5USP7LMNAALDH1A1HSD17B10
SCHEMBL7858676 0.80 TYR (0.54) GAAKMT2ALMNAALDH1A1HSD17B10
SCHEMBL28049538 0.79 HMGCR (0.38) HSPA5GAAUSP7LMNAALDH1A1
SCHEMBL28513369 0.77 SENP1 (0.44) USP7LMNAALDH1A1HSD17B10ESR1
SCHEMBL27526925 0.77 ALDH1A1 (0.54) HSPA5USP7LMNAALDH1A1HSD17B10

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-112105710-B Fluorinated polyacrylate antifoam in ultra low viscosity (< 5 CST) finished fluids 路博润公司 2022-08-30 CN disclosed