SCHEMBL5598714

SCHEMBL5598714

CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4CC(OC(=O)c5ccc(Cl)cc5)CC[C@]4(C)C3CC[C@@]21C

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 1/20 0.69
CYP46A1 Q9Y6A2 2/20 0.68
OSBP P22059 3/20 0.64
USP2 O75604 2/20 0.64
RORC P51449 2/20 0.64
LMNA P02545 1/20 0.64
ABCB1 P08183 1/20 0.64
OSBP2 Q969R2 1/20 0.64
NR1H3 Q13133 4/20 0.57
NPC1L1 Q9UHC9 2/20 0.56
NPC1 O15118 1/20 0.56
CYP1A2 P05177 1/20 0.55
GBA1 P04062 2/20 0.55
UGCG Q16739 2/20 0.55
GBA2 Q9HCG7 2/20 0.55
GRIN1 Q05586 1/20 0.55
GRIN2A Q12879 1/20 0.55
EPHA2 P29317 1/20 0.53
PLA2G2A P14555 1/20 0.53

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
SCHEMBL5598712 1.00 POLA1 (0.69) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL9446914 0.93 POLA1 (0.70) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL14138204 0.93 POLA1 (0.70) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL12154332 0.93 POLA1 (0.70) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL11288161 0.93 POLA1 (0.70) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL17270372 0.93 POLA1 (0.70) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL14097581 0.93 POLA1 (0.70) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL18904679 0.93 POLA1 (0.70) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL5343790 0.92 POLA1 (0.69) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL5343788 0.92 POLA1 (0.69) 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3914497-B2 2007-05-16 JP claimed
EP-1328190-B1 TEMPERATURE MEASURING BALLOON BOSTON SCIENT LTD (BB) 2004-12-29 EP claimed
JP-2004510480-A 2004-04-08 JP claimed
EP-1328190-A2 TEMPERATURE MEASURING BALLOON Boston Scientific Limited (BB) 2003-07-23 EP claimed
US-6450971-B1 Temperature measuring balloon SCIMED LIFE SYSTEMS, INC. 2002-09-17 US claimed
WO-2002028276-A2 TEMPERATURE MEASURING BALLOON SCIMED LIFE SYSTEMS, INC. (US) 2002-04-11 WO claimed
US-7022331-B2 Thermochromic/photochromic cosmetic compositions Theisen, Lyle (US) 2006-04-04 US disclosed
EP-1328190-B1 TEMPERATURE MEASURING BALLOON BOSTON SCIENT LTD (BB) 2004-12-29 EP disclosed
US-20020192247-A1 Thermochromic/photochromic cosmetic compositions THEISEN LYLE (US) 2002-12-19 US disclosed
US-6450971-B1 Temperature measuring balloon SCIMED LIFE SYSTEMS, INC. 2002-09-17 US disclosed
EP-0927753-A1 Liquid crystal dispersed polymer electrooptical films having reverse morphology Sniaricerche S.C.P.A. (IT) 1999-07-07 EP disclosed
US-4064872-A Temperature measuring device of a liquid crystal laminate ASHLEY-BUTLER, INC. (US) 1977-12-27 US disclosed