SCHEMBL3889192

SCHEMBL3889192

Cc1ccc(CC(C)P(=O)(O)O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 2/20 0.44
CA12 O43570 2/20 0.44
CA1 P00915 1/20 0.44
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
ACP3 P15309 2/20 0.42
ACACB O00763 1/20 0.41
MMP2 P08253 2/20 0.41
MMP1 P03956 1/20 0.41
MMP3 P08254 1/20 0.41
MMP7 P09237 1/20 0.41
MMP9 P14780 1/20 0.41
MMP13 P45452 1/20 0.41
MMP14 P50281 1/20 0.41
LAP3 P28838 3/20 0.40
ANPEP P15144 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
HPGD P15428 1/20 0.40
PGK1 P00558 1/20 0.39

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
SCHEMBL22973709 0.82 ACP3 (0.41) LMNAACP3LAP3ANPEPPGK1
SCHEMBL8341042 0.82 LAP3 (0.60) ACP3LAP3ANPEP
SCHEMBL9472683 0.78 ANPEP (0.67) MMP8CA12CA1LMNATSHR
SCHEMBL3885276 0.78 FDFT1 (0.51) MMP8CA12CA1
SCHEMBL3888441 0.78 ACP3 (0.50) MMP8ACP3MMP2MMP1MMP3
SCHEMBL916486 0.74 PGK1 (0.61) MMP8CA12CA1LMNATSHR
SCHEMBL22973753 0.73 ACP3 (0.35) ACP3LAP3ANPEPHPGD
SCHEMBL3896707 0.73 ACP3 (0.77) ACP3LAP3ANPEP
SCHEMBL11481753 0.72 PGK1 (0.59) MMP8CA12CA1LMNATSHR
SCHEMBL8843073 0.72 KMT2A (0.46) MMP8CA12CA1LMNATSHR

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
US-9608291-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-28 US disclosed
US-20150188192-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-07-02 US disclosed
US-20090325065-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2009-12-31 US disclosed