SCHEMBL5884994

SCHEMBL5884994

CCC=COC(=O)CNC(=O)OCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
TSHR P16473 3/20 0.41
HSD17B10 Q99714 2/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX15 P16050 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NR1I2 O75469 1/20 0.39
PGR P06401 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
PTGS2 P35354 1/20 0.39
PDE4D Q08499 1/20 0.39
GAA P10253 2/20 0.39
MGAM O43451 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
EGLN1 Q9GZT9 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
PPID Q08752 1/20 0.33
GLA P06280 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL155270 0.79 GAA (0.41) ALDH1A1TSHRHSD17B10GAAMGAM
SCHEMBL6865666 0.78 GAA (0.60) ALDH1A1TSHRHSD17B10CYP3A4ALOX15
SCHEMBL6865664 0.78 GAA (0.60) ALDH1A1TSHRHSD17B10CYP3A4ALOX15
SCHEMBL2566575 0.78 GAA (0.35) ALDH1A1TSHRHSD17B10CYP3A4GAA
SCHEMBL2482646 0.77 GAA (0.59) ALDH1A1TSHRHSD17B10GAAMGAM
SCHEMBL11184401 0.75 ALDH1A1 (0.56) ALDH1A1TSHRHSD17B10GAAMGAM
Hydrochloric Acid SCHEMBL27762950 0.75 GAA (0.57) ALDH1A1TSHRHSD17B10GAAMGAM
SCHEMBL3455391 0.74 NR1I2 (0.56) ALDH1A1TSHRHSD17B10CYP3A4ALOX15
SCHEMBL3455390 0.74 NR1I2 (0.56) ALDH1A1TSHRHSD17B10CYP3A4ALOX15
SCHEMBL9777099 0.73 GAA (0.37) ALDH1A1TSHRHSD17B10GAAMGAM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230253673-A1 A SHIELDING ARTICLE GLADSTONE CAPITAL CORPORATION 2023-08-10 US disclosed
EP-4171951-A1 A SHIELDING ARTICLE NeoGraf Solutions, LLC (US) 2023-05-03 EP disclosed
WO-2021262634-A1 A SHIELDING ARTICLE NEOGRAF SOLUTIONS, LLC (US) 2021-12-30 WO disclosed
CN-110198818-A Shell mold 耐克创新有限合伙公司 2019-09-03 CN disclosed
US-20180215077-A1 Shell Mold NIKE, INC. 2018-08-02 US disclosed
US-7152343-B2 Footwear system CRONUS, INC. (US) 2006-12-26 US disclosed
US-20050283999-A1 Footwear system CRONUS, INC. 2005-12-29 US disclosed