SCHEMBL7942704

SCHEMBL7942704

C=CC(=O)OCC(CCO)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.50
ALDH1A1 P00352 4/20 0.44
TP53 P04637 3/20 0.44
HIF1A Q16665 3/20 0.44
CYP3A4 P08684 2/20 0.44
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.39
HPGD P15428 1/20 0.36
THRB P10828 2/20 0.34
GRIK1 P39086 2/20 0.31
GRIK2 Q13002 2/20 0.31
CHRM1 P11229 1/20 0.30
AKR1A1 P14550 1/20 0.30
CHRM3 P20309 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
ADRA1A P35348 1/20 0.30
HRH1 P35367 1/20 0.30
DRD3 P35462 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
SCHEMBL11207048 0.89 TSHR (0.47) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL22083641 0.86 TSHR (0.59) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL7760429 0.84 TSHR (0.48) TSHRSLC6A3
SCHEMBL6441778 0.81 TSHR (0.64) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL7573701 0.80 TSHR (0.61) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL7153380 0.79 TSHR (0.62) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL3691878 0.79 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL7761817 0.79 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL5059026 0.79 TSHR (0.57) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL10913592 0.78 TSHR (0.56) TSHRALDH1A1CYP3A4MAPK1HPGD

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
US-4618632-A POLYESTERURETHANES, ACRYLATE REACTIVE DILUENT WESTINGHOUSE ELECTRIC CORP. (US) 1986-10-21 US claimed
CN-103703087-A A one-component, dual-cure adhesive for use on electronics FULLER H B CO 2014-04-02 CN disclosed
CN-103687920-A Two-part dual cure adhesive for use on electronic devices FULLER H B CO 2014-03-26 CN disclosed
WO-2001040396-A2 URETHANE MODIFIED EPOXY ADHESIVE COMPOSITION REICHHOLD, INC. (US) 2001-06-07 WO disclosed
US-5213875-A UV conformal coatings WESTINGHOUSE ELECTRIC CORP. (US) 1993-05-25 US disclosed
US-5013631-A Acrylated resins, urethanes and epoxies, printed circuit boards WESTINGHOUSE ELECTRIC CORP. (US) 1991-05-07 US disclosed
US-4999136-A Electroconductive adhesive, acrylated epoxy resin and urethane WESTINGHOUSE ELECTRIC CORP. (US) 1991-03-12 US disclosed
EP-0385779-A1 Ultraviolet curable conformal coatings WESTINGHOUSE ELECTRIC CORPORATION (US) 1990-09-05 EP disclosed
EP-0361978-A2 Improvements in or relating to resin compositions curable with ultraviolet light WESTINGHOUSE ELECTRIC CORPORATION (US) 1990-04-04 EP disclosed
EP-0311288-A2 Improvements in or relating to resin compositions curable with ultraviolet light WESTINGHOUSE ELECTRIC CORPORATION (US) 1989-04-12 EP disclosed
US-4618632-A POLYESTERURETHANES, ACRYLATE REACTIVE DILUENT WESTINGHOUSE ELECTRIC CORP. (US) 1986-10-21 US disclosed