SCHEMBL15475367

SCHEMBL15475367

C=C(C)C(=O)OCCOC1=CCCC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.44
POLB P06746 1/20 0.40
APEX1 P27695 1/20 0.40
HTT P42858 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TSHR P16473 3/20 0.39
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GSTP1 P09211 1/20 0.32
KMT2A Q03164 1/20 0.30
ATM Q13315 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
Methacrylic Acid SCHEMBL600682 0.86 GSTP1 (0.31) POLBAPEX1HTTTDP1GSTP1
SCHEMBL27662012 0.84 MEN1 (0.31) KMT2A
SCHEMBL4824966 0.84 THRB (0.39) THRBPOLBAPEX1HTTTDP1
SCHEMBL344288 0.84 THRB (0.42) THRBPOLBAPEX1HTTTDP1
SCHEMBL11573490 0.82 THRB (0.35) THRBPOLBAPEX1HTTTDP1
SCHEMBL9301049 0.82 THRB (0.45) THRBPOLBAPEX1HTTTDP1
SCHEMBL7613110 0.80 POLB (0.36) THRBPOLBAPEX1HTTTDP1
SCHEMBL11573487 0.80 THRB (0.43) THRBPOLBAPEX1HTTTDP1
SCHEMBL14662020 0.77 THRB (0.40) THRBPOLBAPEX1HTTTDP1
SCHEMBL3994896 0.77 KMT2A (0.41) ALDH1A1GSTP1KMT2AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2703466-B1 WATER-REPELLENT AND OIL-REPELLENT AGENT COMPOUND, MANUFACTURING METHOD THEREFOR, AND ARTICLE ASAHI GLASS CO LTD (JP) 2018-07-11 EP disclosed
US-9040625-B2 Water/oil repellent composition, method for its production and article ASAHI GLASS COMPANY, LIMITED (JP) 2015-05-26 US disclosed
EP-2703466-A1 WATER-REPELLENT AND OIL-REPELLENT AGENT COMPOUND, MANUFACTURING METHOD THEREFOR, AND ARTICLE Asahi Glass Company, Limited (JP) 2014-03-05 EP disclosed
US-20140051797-A1 WATER/OIL REPELLENT COMPOSITION, METHOD FOR ITS PRODUCTION AND ARTICLE ASAHI GLASS COMPANY, LIMITED (JP) 2014-02-20 US disclosed