SCHEMBL4948313

SCHEMBL4948313

CCC1=C(CC)C(CC)c2cccc3ccc(CC)c1c23

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.33
CASP6 P55212 1/20 0.33
GFER P55789 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MTNR1A P48039 2/20 0.32
MTNR1B P49286 2/20 0.32

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
SCHEMBL27466821 0.82 GABRA1 (0.35) KDM4EMAPTTDP1
Ethylene SCHEMBL11868064 0.79 GABRA1 (0.33)
Carbimide SCHEMBL29029736 0.74 CYP1B1 (0.30)
SCHEMBL28161310 0.69 CYP1A2 (0.31)
SCHEMBL4780918 0.69
SCHEMBL6346391 0.66 HTR2A (0.41) KDM4EALDH1A1HPGD
SCHEMBL6140265 0.66 GABRA1 (0.37)
SCHEMBL22000513 0.64 CYP1B1 (0.43) KDM4EALDH1A1MAPTHPGDTDP1
SCHEMBL7119783 0.63 ALDH1A1 (0.40) NSD2CASP6GFERKDM4EALDH1A1
SCHEMBL11657069 0.62 ALDH1A1 (0.50) NSD2CASP6GFERKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1043793-B1 Secondary battery MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) 2008-04-02 EP claimed
EP-1043793-A2 Secondary battery Matsushita Electric Industrial Co., Ltd. (JP) 2000-10-11 EP claimed
CN-107001566-A Polyurethane-polyurea, its manufacture method and the cosmetic combination comprising the polyurethane-polyurea 株式会社ADEKA 2017-08-01 CN disclosed
EP-1043793-B1 Secondary battery MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) 2008-04-02 EP disclosed
US-6303250-B1 BATTERIES USING NONAQUEOUS ELECTROLYTIC SOLUTION; HIGH TEMPERATURE STORAGE MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2001-10-16 US disclosed
EP-1043793-A2 Secondary battery Matsushita Electric Industrial Co., Ltd. (JP) 2000-10-11 EP disclosed