SCHEMBL30004700

SCHEMBL30004700

C=CC(=O)Oc1c(Br)cc(Br)cc1C(C)CC

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 8/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
PPARA Q07869 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
THRA P10827 5/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31

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
SCHEMBL448738 1.00 THRB (0.35) THRBTSHRTDP1HSD17B10GABRA1
SCHEMBL30486245 0.86 GABRA1 (0.41) THRBTSHRHSD17B10GABRA1GABRB1
SCHEMBL447804 0.86 GABRA1 (0.41) THRBTSHRHSD17B10GABRA1GABRB1
SCHEMBL7065851 0.84 THRB (0.40) THRBTSHRHSD17B10L3MBTL1THRA
SCHEMBL3746023 0.82 TSHR (0.43) THRBTSHRTHRAALDH1A1KMT2A
SCHEMBL7065852 0.79 GPR35 (0.40) THRBTSHRTDP1HSD17B10GABRA1
SCHEMBL316904 0.79 HSD17B10 (0.42) THRBTSHRTDP1HSD17B10GABRA1
SCHEMBL7714546 0.77 THRB (0.36) THRBTSHRTDP1HSD17B10THRA
SCHEMBL7066169 0.76 MAPT (0.34) THRBTDP1HSD17B10GABRA1GABRB1
SCHEMBL7061577 0.74 GABRA1 (0.35) THRBTSHRGABRA1GABRB1L3MBTL1

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
WO-2025099604-A1 WEATHER RESISTANT LIQUID RADIATION CURABLE COMPOSITION STRATASYS LTD. (IL) 2025-05-15 WO disclosed
CN-112424245-B Composition comprising a styrene-isobutylene block copolymer and an ethylenically unsaturated monomer 3M创新有限公司 2024-09-17 CN disclosed
CN-114585604-B Dicarboxylic acid compounds, inorganic particles and compositions thereof treated with dicarboxylic acid compounds 3M创新有限公司 2024-02-02 CN disclosed
CN-113840886-B Composition comprising a styrene-isoprene block copolymer and an ethylenically unsaturated monomer 3M创新有限公司 2023-07-04 CN disclosed
WO-2022219426-A1 COMPOSITIONS, POLYMERIC FILMS, AND ARTICLES INCLUDING A CHEMICAL BLOWING AGENT AND/OR A CROSSLINKER HAVING A PHOTODEGRADABLE LINKAGE, FOAM COMPOSITIONS, METHODS, AND CROSSLINKERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2022-10-20 WO disclosed