SCHEMBL28810486

SCHEMBL28810486

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

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
MME P08473 2/20 0.34
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
BIRC2 Q13490 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
FOLH1 Q04609 1/20 0.31
TP53 P04637 1/20 0.30
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 1/20 0.30

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
SCHEMBL27951379 0.95 CA1 (0.35) CA1CA2MMESLC1A3SLC1A2
SCHEMBL28810487 0.93 CA1 (0.34) CA1CA2MMESLC1A3SLC1A2
SCHEMBL27951378 0.93 CA1 (0.34) CA1CA2MMESLC1A3SLC1A2
SCHEMBL27951362 0.87 CA1 (0.37) CA1CA2MMESMN1; SMN2BIRC2
SCHEMBL4753756 0.82 CA1 (0.42) CA1CA2MMESMN1; SMN2MEN1
SCHEMBL15015843 0.82 CA1 (0.42) CA1CA2MMESMN1; SMN2MEN1
SCHEMBL8980146 0.82 CA1 (0.42) CA1CA2SMN1; SMN2BIRC2MEN1
SCHEMBL4753760 0.82 CA1 (0.42) CA1CA2MMESMN1; SMN2MEN1
SCHEMBL4426492 0.79 CA1 (0.39) CA1CA2MMESMN1; SMN2MEN1
SCHEMBL14601911 0.78 CA1 (0.48) CA1CA2SMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103608406-B Flame-retarded ester ring type polyimide resin composition and thin-walled molding body thereof MITSUBISHI GAS CHEMICAL CO.,INC. (JP) 2016-02-17 CN disclosed
CN-103608406-A Flameproofed alicyclic polyimide resin composition and thin-walled molded body of same MITSUBISHI GAS CHEMICAL CO 2014-02-26 CN disclosed