SCHEMBL5366047

SCHEMBL5366047

C=C(C)C(=O)OC.C=C(C)C(=O)OCCCO

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.58
TSHR P16473 3/20 0.56
THRB P10828 1/20 0.48
POLB P06746 1/20 0.43
APEX1 P27695 1/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ACHE P22303 7/20 0.35
CA1 P00915 2/20 0.33
CA2 P00918 2/20 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
Methoxymethane SCHEMBL2008044 0.92 TSHR (0.60) ALDH1A1TSHRTHRBPOLBAPEX1
SCHEMBL15480 0.92 TSHR (0.64) ALDH1A1TSHRTHRBPOLBAPEX1
SCHEMBL28875212 0.91 TSHR (0.51) ALDH1A1TSHRTHRBPOLBAPEX1
SCHEMBL11802107 0.90 TSHR (0.75) ALDH1A1TSHRTHRBPOLBAPEX1
Potassium SCHEMBL31087662 0.90 TSHR (0.62) ALDH1A1TSHRTHRBPOLBAPEX1
SCHEMBL31250004 0.90 TSHR (0.62) ALDH1A1TSHRTHRBPOLBAPEX1
Water SCHEMBL7119412 0.90 TSHR (0.62) ALDH1A1TSHRTHRBPOLBAPEX1
Ammonia Solution, Strong SCHEMBL28569838 0.90 TSHR (0.62) ALDH1A1TSHRTHRBPOLBAPEX1
Hydrochloric Acid SCHEMBL8398425 0.90 TSHR (0.62) ALDH1A1TSHRTHRBPOLBAPEX1
Lithium SCHEMBL31087663 0.90 TSHR (0.62) ALDH1A1TSHRTHRBPOLBAPEX1

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
WO-2007146909-A2 OPTICAL BRIGHTER AND UV STABILIZER FOR ACRYLIC ENHANCEMENTS ESSCHEM, INC. (US) 2007-12-21 WO disclosed
CN-1124285-C Process for preparing copolymer of continuously changeable components ROHM & HAAS (DE) 2003-10-15 CN disclosed
EP-0861859-B1 Process for preparing continuously variable-composition copolymers ROHMAX ADDITIVES GMBH (DE) 2003-08-06 EP disclosed
US-6140431-A FREE-RADICAL ADDITION COPOLYMERIZATION OF MONOMER MIXTURE HAVING FIRST WEIGHT PERCENT RATIO WITH GRADUAL ADDITION OF SECOND MONOMER MIXTURE OF VARIABLE RATIO TO YIELD CRYSTAL GROWTH INHIBITING LUBRICATING OIL ADDITIVE ROHM AND HAAS COMPANY (US) 2000-10-31 US disclosed
CN-1193024-A Process for preparing copolymer of continuously changeable components ROHM & HAAS (US) 1998-09-16 CN disclosed
EP-0861859-A2 Process for preparing continuously variable-composition copolymers ROHM AND HAAS COMPANY (US) 1998-09-02 EP disclosed
US-3993849-A Metal substrate coated with a thermosetting powder coating composition of an acrylic polymer, a hydroxy functional plasticizer and a blocked polyisocyanate cross-linking agent E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-11-23 US disclosed