SCHEMBL8380418

SCHEMBL8380418

CCc1cc(O)c(O)c(C(C)(C)C)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 2/20 0.67
ALDH1A1 P00352 9/20 0.50
TSHR P16473 3/20 0.50
GAA P10253 3/20 0.50
LMNA P02545 2/20 0.50
CYP1A2 P05177 4/20 0.48
MAPK1 P28482 3/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
CYP3A4 P08684 2/20 0.48
BLM P54132 2/20 0.48
ATM Q13315 2/20 0.48
HIF1A Q16665 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
ALOX15 P16050 2/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
GMNN O75496 1/20 0.48
GABBR2 O75899 1/20 0.48
TP53 P04637 1/20 0.48

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
SCHEMBL39434 0.89 HSPA5 (0.74) HSPA5ALDH1A1TSHRGAALMNA
Hydrochloric Acid SCHEMBL6039741 0.85 HSPA5 (0.69) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL8380423 0.84 GAA (0.50) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL8897086 0.83 HSPA5 (0.67) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL6131132 0.82 HSPA5 (0.61) HSPA5ALDH1A1TSHRGAALMNA
Butylated Hydroxytoluene SCHEMBL4397736 0.82 ALDH1A1 (0.72) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL30467044 0.82 HSPA5 (0.65) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL362006 0.82 HSPA5 (0.65) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL57329 0.82 HSPA5 (0.82) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL6833615 0.80 HSPA5 (0.62) HSPA5ALDH1A1TSHRGAALMNA

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