SCHEMBL8889760

SCHEMBL8889760

CCCCOC(=O)C(O)OC(C)=O

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.59
ATM Q13315 1/20 0.45
TSHR P16473 5/20 0.42
HPGD P15428 1/20 0.42
HCAR2 Q8TDS4 1/20 0.40
NAAA Q02083 1/20 0.39
PRKCA P17252 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
EPHX1 P07099 1/20 0.37
LMNA P02545 1/20 0.37
ESR1 P03372 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
MAPK1 P28482 1/20 0.37
CYP2C19 P33261 1/20 0.37
NR1H2 P55055 1/20 0.37
RNASEL Q05823 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL243205 0.82 ALDH1A1 (0.61) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL17028805 0.80 ALDH1A1 (0.59) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL18915848 0.80 ALDH1A1 (0.59) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL7566937 0.79 ALDH1A1 (0.52) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL8891631 0.79 ALDH1A1 (0.52) ALDH1A1TSHRHPGDTDP1LMNA
SCHEMBL27798764 0.78 ALDH1A1 (0.57) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL15820762 0.78 TSHR (0.65) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL27688771 0.77 ALDH1A1 (0.55) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL19146395 0.77 ALDH1A1 (0.55) ALDH1A1ATMTSHRHPGDHCAR2
Acetic Acid Butyl Ester SCHEMBL3043571 0.77 ALDH1A1 (0.82) ALDH1A1ATMTSHRHPGDHCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5691419-A ACRYLATED RESIN POLYSILOXANES FOR COATINGS BASF LACKE + FARBEN, AG (DE) 1997-11-25 US disclosed
US-5686531-A ACRYLATED POLYSILOXANE MACROMONOMER BASF LACKE + FARBEN, AG (DE) 1997-11-11 US disclosed
US-5483004-A AMINE AND CARBOXY CONTAINING POLYMERS FORMED BY FREE RADICAL POLYMERIZATION BASF LACKE + FARBEN AG (DE) 1996-01-09 US disclosed
US-5336753-A Polyesters modified by tertiary amines, for coatings having rapid low temperature curing BASF LACKE + FARBEN AG (DE) 1994-08-09 US disclosed
US-5283290-A Stress and solvent resistance BASF LACKE & FARBEN AG (DE) 1994-02-01 US disclosed
US-5179191-A Protective coatings for automobiles, varnishes, primers or undercoatings BASF LACKE & FARBEN AKTIENGESELLSCHAFT (DE) 1993-01-12 US disclosed
US-4542192-A Reactive hardenable polymer mixture and process for the preparation of hardened products therefrom HOECHST AKTIENGESELLSCHAFT (DE) 1985-09-17 US disclosed
US-4208488-A POLYESTERS HOECHST AKTIENGESELLSCHAFT (DE) 1980-06-17 US disclosed