SCHEMBL9720464

SCHEMBL9720464

c1ccc(C(CC2CO2)(OC(CC2CO2)(c2ccccc2)C2CO2)C2CO2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 3/20 0.34
GLA P06280 1/20 0.34
TSHR P16473 4/20 0.33
TP53 P04637 3/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33
HIF1A Q16665 2/20 0.33
CYP1A2 P05177 1/20 0.33
PPARG P37231 1/20 0.33
CYP3A4 P08684 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MGLL Q99685 2/20 0.31
CHRM2 P08172 3/20 0.31
CHRM4 P08173 3/20 0.31
CHRM5 P08912 3/20 0.31
CHRM1 P11229 3/20 0.31
CHRM3 P20309 3/20 0.31

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
SCHEMBL8399342 0.81 MEN1 (0.40) MEN1KMT2ATDP1ALDH1A1GLA
SCHEMBL7772962 0.78 MEN1 (0.38) MEN1KMT2ATDP1TSHRCYP1A2
SCHEMBL2052219 0.77 ALDH1A1 (0.40) MEN1KMT2ATDP1ALDH1A1TSHR
SCHEMBL2037524 0.77 MEN1 (0.37) MEN1KMT2ATDP1CYP3A4CHRM2
SCHEMBL7218075 0.76 MEN1 (0.36) MEN1KMT2ATDP1CHRM2CHRM3
SCHEMBL332883 0.76 MEN1 (0.36) MEN1KMT2ATDP1CHRM2CHRM3
SCHEMBL332937 0.74 MEN1 (0.35) MEN1KMT2ACHRM2CHRM3
SCHEMBL25359833 0.74 MEN1 (0.45) MEN1KMT2ATDP1ALDH1A1GLA
SCHEMBL16492411 0.74 MEN1 (0.45) MEN1KMT2ATDP1ALDH1A1GLA
SCHEMBL3319132 0.74 MEN1 (0.45) MEN1KMT2ATDP1ALDH1A1GLA

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-114057992-A Resin composition for carbon fiber molding 上纬新材料科技股份有限公司 2022-02-18 CN claimed
CN-113150221-A Unsaturated polyester and free radical modified epoxy resin composition 上纬新材料科技股份有限公司 2021-07-23 CN claimed
US-5093424-A For metals, quick curing, no foaming, corrosion resistance, good processability KANSAI PAINT CO., LTD. (JP) 1992-03-03 US disclosed