SCHEMBL5666402

SCHEMBL5666402

C=CC(=O)OC(CC)OCCCO

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 4/20 0.36
CYP3A4 P08684 2/20 0.36
TP53 P04637 3/20 0.32
HIF1A Q16665 3/20 0.32
HSD17B10 Q99714 1/20 0.32
THRB P10828 1/20 0.32
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL11581248 0.92 TSHR (0.38) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL105694 0.88 TSHR (0.55) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL4957917 0.85 TSHR (0.47) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL28348648 0.85 TSHR (0.47) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL2145660 0.84 TSHR (0.44) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL10697749 0.81 TSHR (0.50) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL5369953 0.81 TSHR (0.50) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL237171 0.80 TSHR (0.39) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL1138627 0.80 TSHR (0.45) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL28463101 0.80 TSHR (0.41) TSHRHPGDALDH1A1CYP3A4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7105207-B2 UV curable oligomeric adhesive compositions suitable for use in flexible packaging applications ASHLAND LICENSING AND INTELLECTUAL PROPERTY LLC (US) 2006-09-12 US disclosed
US-20040029991-A1 UV curable oligomeric adhesive compositions suitable for use in flexible packaging applications ARKEMA FRANCE (FR) 2004-02-12 US disclosed
US-4147764-A POLY(HYDROXYALKYL ACRYLATE), ACTIVATED CARBON, ANTIGEN NATIONAL PATENT DEVELOPMENT CORPORATION (US) 1979-04-03 US disclosed
US-4081402-A DISPERSION OF MICROPOROUS PARTICULATE SORBENT IN HYDROPHILIC POLYMER NATIONAL PATENT DEVELOPMENT CORPORATION (US) 1978-03-28 US disclosed
US-3935342-A POLYMERIZATION WITH AN UNSATURATED SILYL MONOMER MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1976-01-27 US disclosed