SCHEMBL4480101

SCHEMBL4480101

COc1c(C)ccc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 6/20 0.49
PDE4A P27815 5/20 0.49
PDE4C Q08493 5/20 0.49
PDE4D Q08499 5/20 0.49
ESR2 Q92731 1/20 0.40
SQOR Q9Y6N5 1/20 0.39
CYP2A6 P11509 2/20 0.38
CYP2B6 P20813 1/20 0.38
ALOX5AP P20292 1/20 0.38
FEN1 P39748 1/20 0.38
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KCNA3 P22001 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPK1 P28482 1/20 0.37
CYP3A4 P08684 1/20 0.36
MGAM O43451 1/20 0.35
GAA P10253 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35

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
SCHEMBL5184749 0.84 PDE4B (0.43) PDE4BPDE4APDE4CPDE4DESR2
SCHEMBL3643547 0.81 NPC1 (0.54) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL2492749 0.79 PDE4B (0.47) PDE4BPDE4APDE4CPDE4DSQOR
SCHEMBL56424 0.79 PDE4B (0.47) PDE4BPDE4APDE4CPDE4DSQOR
SCHEMBL10599819 0.79 ESR2 (0.40) PDE4BPDE4APDE4CPDE4DESR2
SCHEMBL9376230 0.79 PDE4B (0.47) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL17038908 0.78 PDE4B (0.58) PDE4BPDE4APDE4CPDE4DSQOR
SCHEMBL11573641 0.77 ESR2 (0.47) ESR2CYP2A6CYP2B6ALDH1A1SMN1; SMN2
SCHEMBL28039230 0.77 PDE4B (0.50) PDE4BPDE4APDE4CPDE4DSQOR
SCHEMBL28977458 0.77 PDE4B (0.45) PDE4BPDE4APDE4CPDE4DALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120288752-A1 ADDITIVE FOR OVERCHARGE PREVENTING OF SECONDARY BATTERY AND NONAQUEOUS ELECTROLYTE FOR SECONDARY BATTERY INCLUDING THE SAME SAMSUNG CORNING PRECISION MATERIALS CO., LTD. 2012-11-15 US claimed
EP-2523247-A1 Additive for overcharge preventing of secondary battery and non-aqueous electrolyte for secondary battery including the same Samsung Corning Precision Materials Co., Ltd. (KR) 2012-11-14 EP claimed
EP-1498432-B1 PROCESS FOR PRODUCING HIGHLY FLOWABLE PROPYLENE POLYMER AND HIGHLY FLOWABLE PROPYLENE POLYMER IDEMITSU KOSAN CO (JP) 2009-09-02 EP disclosed
US-20050159566-A1 improved flexibility, and transparency, heat sealability and hot tackiness; good softness, a less stickiness, and an good compatibility with polyolefin resins; for sanitary materials, packing, bookbinding, fibers IDEMITSU KOSAN CO., LTD (JP) 2005-07-21 US disclosed
EP-1498432-A1 PROCESS FOR PRODUCING HIGHLY FLOWABLE PROPYLENE POLYMER AND HIGHLY FLOWABLE PROPYLENE POLYMER IDEMITSU KOSAN COMPANY LIMITED (JP) 2005-01-19 EP disclosed