SCHEMBL7452399

SCHEMBL7452399

C=CC(=O)OCCCCOc1cc(OCCCCOC(=O)C=C)cc(C(=O)OC2CC[C@@]3(C)C(=CCC4C3CC[C@@]3(C)C4CC[C@@H]3[C@H](C)CCCC(C)C)C2)c1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 1/20 0.59
CYP46A1 Q9Y6A2 2/20 0.58
OSBP P22059 3/20 0.54
USP2 O75604 2/20 0.54
RORC P51449 2/20 0.54
LMNA P02545 1/20 0.54
ABCB1 P08183 1/20 0.54
OSBP2 Q969R2 1/20 0.54
PLA2G2A P14555 1/20 0.54
GBA1 P04062 2/20 0.52
UGCG Q16739 2/20 0.52
GBA2 Q9HCG7 2/20 0.52
NR1H3 Q13133 2/20 0.49
CYP1A2 P05177 1/20 0.49
NPC1L1 Q9UHC9 3/20 0.49
NPC1 O15118 1/20 0.49
GRIN1 Q05586 1/20 0.47
GRIN2A Q12879 1/20 0.47

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
SCHEMBL7452395 1.00 POLA1 (0.59) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL7655422 0.93 POLA1 (0.59) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL18470121 0.93 POLA1 (0.59) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL7655418 0.93 POLA1 (0.59) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL19958469 0.90 POLA1 (0.57) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL8436533 0.88 POLA1 (0.57) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL816262 0.88 POLA1 (0.55) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL19759234 0.87 POLA1 (0.60) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL12115642 0.87 PLA2G2A (0.64) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL18722270 0.87 PLA2G2A (0.64) POLA1CYP46A1OSBPUSP2RORC

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-1046692-B1 Thermostable pigments, films, effect coatings and mixtures for their preparation CONSORTIUM ELEKTROCHEM IND (DE) 2002-08-07 EP disclosed
US-6423246-B1 LIQUID CRYSTAL POLYMERS AND CROSSLINKING CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 2002-07-23 US disclosed
EP-1046692-A1 Thermostable pigments, films, effect coatings and mixtures for their preparation Consortium für elektrochemische Industrie GmbH (DE) 2000-10-25 EP disclosed