SCHEMBL6024939

SCHEMBL6024939

C=C(C)C(=O)OCCO.C=Cc1ccncc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.40
THRB P10828 1/20 0.39
POLB P06746 1/20 0.39
APEX1 P27695 1/20 0.39
HTT P42858 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TSHR P16473 4/20 0.38
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
JUN P05412 1/20 0.34
NFKB1 P19838 1/20 0.34
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP19A1 P11511 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32

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
SCHEMBL28116495 0.91 THRB (0.43) SNCATHRBPOLBAPEX1HTT
Styrene SCHEMBL409075 0.87 TDP1 (0.43) THRBPOLBAPEX1HTTTDP1
Styrene SCHEMBL9305623 0.87 TDP1 (0.43) THRBPOLBAPEX1HTTTDP1
SCHEMBL27861823 0.86 TSHR (0.54) SNCATHRBPOLBAPEX1HTT
4-Vinylphenol SCHEMBL9490113 0.85 THRB (0.39) THRBPOLBAPEX1HTTTDP1
SCHEMBL9126871 0.85 CA1 (0.44) THRBPOLBAPEX1HTTTDP1
SCHEMBL9776540 0.85 BCHE (0.50) SNCATHRBPOLBAPEX1HTT
Styrene SCHEMBL28447649 0.84 TDP1 (0.41) THRBPOLBAPEX1HTTTDP1
Styrene SCHEMBL11239895 0.84 TDP1 (0.41) THRBPOLBAPEX1HTTTDP1
SCHEMBL10914215 0.83 TSHR (0.63) THRBPOLBAPEX1HTTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112316922-B Preservative adsorption microsphere as well as preparation method and application thereof 南通大学 2023-12-12 CN disclosed
CN-112337446-B Pellet capable of rapidly removing preservative as well as preparation method and application thereof 南通大学 2023-10-31 CN disclosed
CN-112221199-B Antiseptic remove device of cosmetics 南通大学 2022-06-21 CN disclosed
CN-112220700-B Preservative specific adsorption multi-pore gel and preparation method and application thereof 南通大学 2022-04-01 CN disclosed
CN-112337446-A Small ball capable of quickly removing preservative as well as preparation method and application thereof 南通大学 2021-02-09 CN disclosed
CN-112316922-A Preservative adsorption microsphere and preparation method and application thereof 南通大学 2021-02-05 CN disclosed
CN-112221199-A Antiseptic remove device of cosmetics 南通大学 2021-01-15 CN disclosed
CN-112220700-A Preservative specific adsorption multi-pore gel and preparation method and application thereof 南通大学 2021-01-15 CN disclosed
US-20060257441-A1 Natural essential oil sanitary insect pest repellent and its use SUZUKI YUSHI INDUSTRIAL CO., LTD. (JP) 2006-11-16 US disclosed
EP-0243177-B1 CATALYTIC PRODUCTION OF POLYAMIDE BLOCK COPOLYMERS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-07-07 EP disclosed
US-4775721-A Process for producing polyamide block copolymer SUMIMOTO CHEMICAL COMPANY, LIMITED (JP) 1988-10-04 US disclosed
EP-0243177-A1 Catalytic production of polyamide block copolymers SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-10-28 EP disclosed