SCHEMBL816446

SCHEMBL816446

OCCOC1CCC(c2cccc(C3(c4cccc(C5CCC(OCCO)CC5)c4)c4ccccc4-c4ccccc43)c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 6/20 0.39
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
AKR1A1 P14550 1/20 0.34
AKR1B1 P15121 1/20 0.34
DRD2 P14416 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
OPRK1 P41145 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
SIGMAR1 Q99720 1/20 0.30
SLC18A3 Q16572 1/20 0.30

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
SCHEMBL27130350 0.79 PDK2 (0.49) PDK2ESR1ESR2AKR1A1AKR1B1
SCHEMBL8466348 0.76 SLC18A3 (0.49) ESR2SIGMAR1SLC18A3
SCHEMBL19381000 0.76 SLC18A3 (0.49) ESR2SIGMAR1SLC18A3
SCHEMBL13713753 0.74 PDK2 (0.42) PDK2LMNAKMT2A
SCHEMBL29254147 0.71 MEN1 (0.44) PDK2ESR1ESR2AKR1A1AKR1B1
SCHEMBL8372995 0.70 PDK2 (0.53) PDK2ESR1ESR2KDM4EMEN1
SCHEMBL5035479 0.67 ESR1 (0.39) PDK2ESR1ESR2KDM4EMEN1
SCHEMBL1490274 0.66 PDK2 (0.49) PDK2ESR1ESR2
SCHEMBL382823 0.66 SLC6A9 (0.43) PDK2ESR1ESR2
SCHEMBL29445698 0.66 SLC6A9 (0.43) PDK2ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10717866-B2 Organic-inorganic hybrid composition, and article and optical component including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-07-21 US disclosed
US-20180244915-A1 ORGANIC-INORGANIC HYBRID COMPOSITION, AND ARTICLE AND OPTICAL COMPONENT INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-08-30 US disclosed
US-8436129-B2 Polycarbonate resin having ultraviolet absorbing capability, resin composition and optical material MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2013-05-07 US disclosed
US-20120116000-A1 POLYCARBONATE RESIN COMPOSITION, AND PROCESS FOR PRODUCING MOLDED PRODUCTS AND OPTICAL LENS USING THE SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2012-05-10 US disclosed
US-8058384-B2 Method for producing thermoplastic resin, polyester resin and polycarbonate resin, and their applications MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2011-11-15 US disclosed
US-20110112271-A1 POLYCARBONATE RESIN HAVING ULTRAVIOLET ABSORBING CAPACITY, RESIN COMPOSITION AND OPTICAL MATERIAL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2011-05-12 US disclosed
US-20100144995-A1 METHOD FOR PRODUCING THERMOPLASTIC RESIN, POLYESTER RESIN AND POLYCARBONATE RESIN, AND THEIR APPLICATIONS MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2010-06-10 US disclosed