SCHEMBL28072205

SCHEMBL28072205

CCCCCCCCCCCCCCCCC1(c2ccccc2)OC1c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 6/20 0.43
MMP9 P14780 6/20 0.43
MMP3 P08254 2/20 0.43
KDM1A O60341 2/20 0.37
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
MMP8 P22894 3/20 0.36
MMP13 P45452 3/20 0.36
CHRM2 P08172 2/20 0.35
CHRM4 P08173 2/20 0.35
CHRM5 P08912 2/20 0.35
CHRM1 P11229 2/20 0.35
CHRM3 P20309 2/20 0.35
FAAH O00519 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MEN1 O00255 1/20 0.35
RECQL P46063 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL11699378 0.87 KDM1A (0.45) KDM1AMAOAMAOBCHRM2CHRM4
SCHEMBL6941360 0.82 MMP2 (0.46) MMP2MMP9MMP3MMP8MMP13
SCHEMBL27265071 0.82 MMP2 (0.46) MMP2MMP9MMP3MMP8MMP13
SCHEMBL6939075 0.82 MMP2 (0.46) MMP2MMP9MMP3MMP8MMP13
SCHEMBL28606146 0.79 MMP2 (0.44) MMP2MMP9MMP3MMP8MMP13
SCHEMBL1902463 0.78 MMP2 (0.43) MMP2MMP9MMP3MMP8MMP13
SCHEMBL12656180 0.75 OPRM1 (0.41) MMP2MMP9MMP3FAAHCYP2C9
SCHEMBL11003541 0.73 PTGS2 (0.45) KDM1AMAOAMAOBCHRM2CHRM4
SCHEMBL8993540 0.73 PTGS2 (0.45) KDM1AMAOAMAOBCHRM2CHRM4
SCHEMBL3720341 0.73 PTGS2 (0.45) KDM1AMAOAMAOBCHRM2CHRM4

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
CN-107207738-A Metal complex, metal nanostructure and catalyst composition comprising the same 株式会社LG化学 2017-09-26 CN disclosed
CN-107207719-A Linear inorganic coordination polymers, metal complexes, metal nanostructures, and catalyst compositions comprising the same 株式会社LG化学 2017-09-26 CN disclosed
CN-105722888-A Method for preparing polyalkylene carbonate resin LG化学株式会社 2016-06-29 CN disclosed