SCHEMBL7933889

SCHEMBL7933889

Cc1ccc(C(O)C(O)c2ccc(C)cc2C(C)(C)C)c(C(C)(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.46
ALDH1A1 P00352 4/20 0.46
TYR P14679 2/20 0.46
CA2 P00918 1/20 0.46
POLB P06746 1/20 0.46
TRPA1 O75762 2/20 0.42
LMNA P02545 2/20 0.42
CHRM1 P11229 1/20 0.42
SLC6A2 P23975 1/20 0.42
ADRA1A P35348 1/20 0.42
HTR2B P41595 1/20 0.42
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
HSPA5 P11021 1/20 0.38
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 1/20 0.37
HIF1A Q16665 1/20 0.37
TSHR P16473 2/20 0.37
USP2 O75604 1/20 0.37
TDP1 Q9NUW8 1/20 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
Hydrogen Peroxide SCHEMBL8659528 0.83 TRPA1 (0.53) SMN1; SMN2ALDH1A1TYRCA2POLB
SCHEMBL9355749 0.83 TRPA1 (0.42) SMN1; SMN2ALDH1A1TYRCA2POLB
SCHEMBL31439401 0.83 TRPA1 (0.52) SMN1; SMN2ALDH1A1TYRCA2POLB
SCHEMBL14211932 0.81 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1TYRCA2POLB
SCHEMBL7943128 0.78 ALDH1A1 (0.45) SMN1; SMN2ALDH1A1TYRCA2LMNA
SCHEMBL20155899 0.78 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1TYRCA2POLB
SCHEMBL9329822 0.74 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1TYRCA2POLB
SCHEMBL9356380 0.74 SMN1; SMN2 (0.35) SMN1; SMN2ALDH1A1TYRCA2POLB
SCHEMBL17594923 0.74 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1TYRCA2POLB
SCHEMBL9860912 0.74 TSHR (0.38) SMN1; SMN2ALDH1A1TYRCA2POLB

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-6242514-B1 CYCLIC PHOSPHATE OR PHOSPHONATE; HEAT AND OXIDATION STABILIZER ESPECIALLY FOR OLEFIN POLYMERS AND ENGINEERING THERMOPLASTICS SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2001-06-05 US disclosed