SCHEMBL8395806

SCHEMBL8395806

CCc1c(CC)c(Cc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c(CC)c(CC)c1Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 2/20 0.58
ALDH1A1 P00352 8/20 0.52
TSHR P16473 3/20 0.52
GAA P10253 3/20 0.52
LMNA P02545 2/20 0.52
MAPK1 P28482 3/20 0.50
HIF1A Q16665 3/20 0.50
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
CYP1A2 P05177 2/20 0.50
CYP3A4 P08684 2/20 0.50
BLM P54132 2/20 0.50
ATM Q13315 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
TP53 P04637 2/20 0.50
CYP2C9 P11712 2/20 0.50
CYP2C19 P33261 2/20 0.50
ALOX15 P16050 2/20 0.50
GMNN O75496 1/20 0.50
GABBR2 O75899 1/20 0.50

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
SCHEMBL2147907 1.00 HSPA5 (0.58) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL11413689 0.90 HSPA5 (0.51) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL10752845 0.86 HSPA5 (0.45) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL9063439 0.85 HSPA5 (0.42) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL20699470 0.85 HSPA5 (0.50) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL11074607 0.85 ALDH1A1 (0.55) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL8268168 0.84 HSPA5 (0.62) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL7762204 0.84 HSPA5 (0.62) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL39559 0.83 ALDH1A1 (0.63) HSPA5ALDH1A1TSHRGAALMNA
SCHEMBL11026220 0.83 ALDH1A1 (0.50) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE36128-E STABILIZER FOR ORGANIC COMPOUNDS ALBEMARLE CORPORATION (US) 1999-03-02 US disclosed
EP-0280938-B1 Antioxidant aromatic fluorophosphites ETHYL CORP (US) 1994-06-15 EP disclosed
US-4912155-A Containing substituted aryl group ETHYL CORPORATION (US) 1990-03-27 US disclosed
EP-0280938-A1 Antioxidant aromatic fluorophosphites ALBEMARLE CORPORATION (US) 1988-09-07 EP disclosed