SCHEMBL5716611

SCHEMBL5716611

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

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
LMNA P02545 2/20 0.34
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
TSHR P16473 2/20 0.32
FFAR3 O14843 3/20 0.32
HDAC3 O15379 3/20 0.32
HDAC1 Q13547 3/20 0.32
HDAC2 Q92769 3/20 0.32
HDAC8 Q9BY41 3/20 0.32
MAPT P10636 1/20 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
SCHEMBL27822863 0.88 LMNA (0.40) ALDH1A1LMNACES2CES1TSHR
SCHEMBL3476792 0.85 LMNA (0.44) ALDH1A1LMNACES2CES1TSHR
SCHEMBL28200529 0.85 ALDH1A1 (0.36) ALDH1A1LMNACES2CES1TSHR
SCHEMBL820057 0.85 LMNA (0.50) ALDH1A1LMNACES2CES1MAPT
SCHEMBL16499607 0.85 LMNA (0.50) ALDH1A1LMNACES2CES1MAPT
SCHEMBL2799572 0.83 TSHR (0.34) TSHR
SCHEMBL27542981 0.82 TSHR (0.35) ALDH1A1LMNACES2CES1TSHR
SCHEMBL19471282 0.82 LMNA (0.33) ALDH1A1LMNACES2CES1TSHR
SCHEMBL9787187 0.80 LMNA (0.32) ALDH1A1LMNACES2CES1TSHR
Phosphoric Acid SCHEMBL21612166 0.79 LMNA (0.45) LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116355129-A Multi-carboxyl density functional polycarboxylate superplasticizer and preparation method thereof 江苏超力建材科技有限公司 2023-06-30 CN claimed
CN-116355129-A Multi-carboxyl density functional polycarboxylate superplasticizer and preparation method thereof 江苏超力建材科技有限公司 2023-06-30 CN disclosed
CN-116355129-A Multi-carboxyl density functional polycarboxylate superplasticizer and preparation method thereof 江苏超力建材科技有限公司 2023-06-30 CN disclosed
WO-2016104982-A1 AZO MONOMER, AND AZO POLYMER PREPARED BY POLYMERIZATION OF AZO MONOMER 주식회사 엘지화학 2016-06-30 WO disclosed
EP-1727867-A1 CURABLE LIQUID RESIN COMPOSITION DSMIP Assets B.V. (NL) 2006-12-06 EP disclosed
WO-2005090488-A1 CURABLE LIQUID RESIN COMPOSITION DSM IP ASSETS B.V. (NL) 2005-09-29 WO disclosed
WO-1995002621-A1 GLASS MODULE AND A METHOD FOR MOUNTING WINDOWS ESSEX SPECIALTY PRODUCTS, INC. (US) 1995-01-26 WO disclosed
US-5063269-A Unsaturated urethane ESSEX SPECIALTY PRODUCTS, INC. (US) 1991-11-05 US disclosed
EP-0439040-A1 One-part primerless adhesive ESSEX SPECIALTY PRODUCTS, INC. (US) 1991-07-31 EP disclosed
EP-0068487-B1 CURABLE MOLDING COMPOSITIONS UNION CARBIDE CORPORATION (US) 1986-12-30 EP disclosed
EP-0068487-A2 Curable molding compositions UNION CARBIDE CORPORATION (US) 1983-01-05 EP disclosed