SCHEMBL7754837

SCHEMBL7754837

CCCCC(CCC)CCCCC(CCCCC(CCCCC(CCC)CCCC)CC(O)=S)CC(O)=S

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
LMNA P02545 1/20 0.40
TDP1 Q9NUW8 1/20 0.35
CYP3A4 P08684 1/20 0.34
TSHR P16473 1/20 0.34
GPR84 Q9NQS5 7/20 0.34
CA2 P00918 3/20 0.33
MAPK1 P28482 1/20 0.33
FFAR1 O14842 1/20 0.32
MAPT P10636 1/20 0.31
LCK P06239 1/20 0.31
PPARD Q03181 1/20 0.31
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31

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
SCHEMBL7756660 0.98 ALDH1A1 (0.39) ALDH1A1LMNATDP1CYP3A4TSHR
SCHEMBL7758039 0.94 ALDH1A1 (0.41) ALDH1A1LMNATDP1CYP3A4TSHR
SCHEMBL7756102 0.92 LMNA (0.45) ALDH1A1LMNATDP1CYP3A4TSHR
SCHEMBL7752017 0.92 LMNA (0.45) ALDH1A1LMNATDP1CYP3A4TSHR
SCHEMBL7752033 0.92 LMNA (0.45) ALDH1A1LMNATDP1CYP3A4TSHR
SCHEMBL7752149 0.90 LMNA (0.48) ALDH1A1LMNAGPR84CA2FFAR1
SCHEMBL7752021 0.89 ALDH1A1 (0.33) ALDH1A1LMNACYP3A4TSHR
SCHEMBL7756148 0.89 ALDH1A1 (0.41) ALDH1A1LMNATDP1CYP3A4TSHR
SCHEMBL7752041 0.88 CYP3A4 (0.33) ALDH1A1LMNACYP3A4MAPT
SCHEMBL7756128 0.88 CYP3A4 (0.33) ALDH1A1LMNACYP3A4MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0764636-B1 Thiopropionate synergists GOODYEAR TIRE & RUBBER (US) 2001-03-07 EP disclosed
US-5672730-A OXIDATION RESIST STABILIZER FOR POLYMERIC BLENDS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1997-09-30 US disclosed
EP-0764636-A2 Thiopropionate synergists THE GOODYEAR TIRE & RUBBER COMPANY (US) 1997-03-26 EP disclosed