SCHEMBL8380423

SCHEMBL8380423

CCCc1cc(O)c(O)c(C(C)(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.50
KMT2A Q03164 3/20 0.50
HSPA5 P11021 1/20 0.49
ALDH1A1 P00352 8/20 0.47
TSHR P16473 3/20 0.47
LMNA P02545 2/20 0.47
MAPK1 P28482 4/20 0.46
CYP1A2 P05177 3/20 0.46
NPSR1 Q6W5P4 3/20 0.46
MEN1 O00255 2/20 0.46
CYP3A4 P08684 2/20 0.46
BLM P54132 2/20 0.46
ATM Q13315 2/20 0.46
HIF1A Q16665 2/20 0.46
ALOX15 P16050 2/20 0.46
GMNN O75496 1/20 0.46
GABBR2 O75899 1/20 0.46
TP53 P04637 1/20 0.46
CYP2C9 P11712 1/20 0.46
NFKB1 P19838 1/20 0.46

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
SCHEMBL163700 0.90 GAA (0.58) GAAKMT2AHSPA5ALDH1A1TSHR
Hydrazine SCHEMBL28652103 0.86 GAA (0.56) GAAKMT2AHSPA5ALDH1A1TSHR
SCHEMBL19383135 0.85 GAA (0.50) GAAKMT2AHSPA5ALDH1A1TSHR
SCHEMBL8380418 0.84 HSPA5 (0.67) GAAKMT2AHSPA5ALDH1A1TSHR
SCHEMBL9270169 0.83 CA2 (0.48) GAAKMT2AHSPA5ALDH1A1TSHR
SCHEMBL23650047 0.83 GAA (0.53) GAAKMT2AHSPA5ALDH1A1TSHR
SCHEMBL1626161 0.83 CYP1A2 (0.55) GAAKMT2AHSPA5ALDH1A1TSHR
SCHEMBL14237449 0.81 GAA (0.48) GAAKMT2AHSPA5ALDH1A1TSHR
SCHEMBL3138594 0.81 HSPA5 (0.74) GAAKMT2AHSPA5ALDH1A1TSHR
SCHEMBL19731238 0.81 GAA (0.48) GAAKMT2AHSPA5ALDH1A1TSHR

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
US-5902516-A STABILIZER FOR THERMOPLASTIC POLYOLEFIN OR ENGINEERING RESINS SUMITOMO CHEMICAL CO., LTD (JP) 1999-05-11 US disclosed