SCHEMBL6276285

SCHEMBL6276285

CCOC(C)(OCC)OC(=O)CC(=O)O

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.34
MGAM O43451 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
LDHA P00338 1/20 0.32
SRR Q9GZT4 1/20 0.32
FFAR3 O14843 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
TSHR P16473 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
HMGCR P04035 1/20 0.30
CHRM1 P11229 1/20 0.30
TBXA2R P21731 1/20 0.30
ADRA1A P35348 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
SCHEMBL6276282 0.89 GAA (0.44) GAAMGAMSIMGAM2TSHR
SCHEMBL297784 0.82 EGLN1 (0.41) FFAR3EGLN1TSHRMEN1KMT2A
SCHEMBL440012 0.81 MGAM (0.36) GAAMGAMSIMGAM2LDHA
SCHEMBL297783 0.80 TSHR (0.36) GAAMGAMSIMGAM2TSHR
SCHEMBL28299790 0.80 ALDH1A1 (0.33) GAAMGAMSIMGAM2
SCHEMBL522534 0.79 TSHR (0.44) TSHRMEN1KMT2A
SCHEMBL10923824 0.79 TSHR (0.48) TSHRMEN1KMT2A
SCHEMBL6276296 0.78 TSHR (0.37) GAAMGAMSIMGAM2LDHA
SCHEMBL27417917 0.78 ALDH1A1 (0.32) GAAFFAR3
SCHEMBL9752076 0.78 MGAM (0.33) GAAMGAMSIMGAM2LDHA

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
CN-111278412-A Powdered composition 株式会社资生堂 2020-06-12 CN disclosed
CN-111278411-A Powdered composition 株式会社资生堂 2020-06-12 CN disclosed
US-20050123781-A1 One-component flexible etch resistant clearcoat NIPPON PAINT (USA), INC. 2005-06-09 US disclosed
EP-1538172-A1 One-component flexible etch resistant clearcoat ROHM AND HAAS COMPANY (US) 2005-06-08 EP disclosed