SCHEMBL8980146

SCHEMBL8980146

CCC(C(=O)OC)C(C)C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.39
CA14 Q9ULX7 3/20 0.37
ZDHHC7 Q9NXF8 1/20 0.35
CA12 O43570 3/20 0.34
MMP1 P03956 2/20 0.34
MMP2 P08253 2/20 0.34
MMP3 P08254 1/20 0.34
ABCB1 P08183 1/20 0.34
BIRC2 Q13490 1/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 1/20 0.33
MIF P14174 1/20 0.32
CA9 Q16790 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
SCHEMBL27951362 0.87 CA1 (0.37) CA1CA2SMN1; SMN2CA14ZDHHC7
SCHEMBL4426492 0.86 CA1 (0.39) CA1CA2SMN1; SMN2CA14ZDHHC7
SCHEMBL16626822 0.85 CA1 (0.48) CA1CA2SMN1; SMN2CA14ZDHHC7
SCHEMBL14601911 0.85 CA1 (0.48) CA1CA2SMN1; SMN2CA14ZDHHC7
SCHEMBL7433060 0.83 SMN1; SMN2 (0.46) CA1CA2SMN1; SMN2CA14ZDHHC7
SCHEMBL13443752 0.83 SMN1; SMN2 (0.46) CA1CA2SMN1; SMN2CA14ZDHHC7
SCHEMBL13443753 0.83 SMN1; SMN2 (0.46) CA1CA2SMN1; SMN2CA14ZDHHC7
SCHEMBL28810486 0.82 CA1 (0.34) CA1CA2SMN1; SMN2BIRC2MEN1
SCHEMBL28810487 0.82 CA1 (0.34) CA1CA2SMN1; SMN2BIRC2MEN1
SCHEMBL30561836 0.81 CA1 (0.42) CA1CA2SMN1; SMN2CA14ZDHHC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5563290-A Method for preparing optically active succinic acid compound NIPPON OIL CO. LTD. (JP) 1996-10-08 US claimed
US-20160333251-A1 USE OF A COPOLYMER MADE FROM STYRENE SULPHONIC ACID TO INHIBIT OR SLOW THE FORMATION OF SULPHIDE DEPOSITS TOTAL SA (FR) 2016-11-17 US disclosed
US-5563290-A Method for preparing optically active succinic acid compound NIPPON OIL CO. LTD. (JP) 1996-10-08 US disclosed
EP-0663382-A1 Process for preparing optically active succinic acid compound NIPPON OIL CO. LTD. (JP) 1995-07-19 EP disclosed