SCHEMBL4647910

SCHEMBL4647910

C=C(C(=O)O)c1c(Br)cc(CCCCCCCCCCCC)cc1Br

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRA P10827 5/20 0.48
THRB P10828 5/20 0.48
GPR84 Q9NQS5 2/20 0.45
PTGS2 P35354 3/20 0.45
KAT8 Q9H7Z6 2/20 0.42
PPARA Q07869 1/20 0.42
CYP3A4 P08684 1/20 0.42
ALDH1A1 P00352 2/20 0.41
HAO1 Q9UJM8 1/20 0.41
RARB P10826 4/20 0.41
MEN1 O00255 1/20 0.41
RARA P10276 1/20 0.41
MAPT P10636 1/20 0.41
MTOR P42345 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL4647509 1.00 THRA (0.48) THRATHRBGPR84PTGS2KAT8
SCHEMBL1804602 0.75 THRA (0.47) THRATHRBGPR84PTGS2KAT8
Acrylic Acid SCHEMBL31244468 0.75 THRB (0.49) THRATHRBGPR84PTGS2MEN1
Acrylic Acid SCHEMBL31244469 0.75 THRB (0.49) THRATHRBGPR84PTGS2MEN1
SCHEMBL1804530 0.75 THRA (0.47) THRATHRBGPR84PTGS2KAT8
SCHEMBL2356093 0.74 ALDH1A1 (0.41) THRATHRBGPR84KAT8PPARA
SCHEMBL4646891 0.73 PTGS2 (0.62) THRATHRBGPR84PTGS2CYP3A4
SCHEMBL7618724 0.73 PTGS2 (0.62) THRATHRBGPR84PTGS2CYP3A4
SCHEMBL2356098 0.73 THRA (0.67) THRATHRBALDH1A1HAO1RARB
SCHEMBL10651489 0.73 THRA (0.67) THRATHRBALDH1A1HAO1RARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2938689-B1 OPTICALLY CLEAR HOT MELT PROCESSABLE HIGH REFRACTIVE INDEX ADHESIVES 3M INNOVATIVE PROPERTIES CO (US) 2018-07-11 EP claimed
EP-1244756-B2 HIGH REFRACTIVE INDEX PRESSURE-SENSITIVE ADHESIVES 3M INNOVATIVE PROPERTIES CO (US) 2008-08-20 EP claimed
EP-1244756-B1 HIGH REFRACTIVE INDEX PRESSURE-SENSITIVE ADHESIVES 3M INNOVATIVE PROPERTIES CO (US) 2004-10-27 EP claimed