SCHEMBL28645496

SCHEMBL28645496

C=C(C(=O)O)c1ccc(CCCC)cc1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RARB P10826 6/20 0.62
THRA P10827 6/20 0.60
THRB P10828 6/20 0.60
ALDH1A1 P00352 3/20 0.58
HPGD P15428 1/20 0.58
HSD17B10 Q99714 1/20 0.58
PLK1 P53350 1/20 0.57
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
RARA P10276 1/20 0.54
MAPT P10636 1/20 0.54
MTOR P42345 1/20 0.54
TRPV1 Q8NER1 1/20 0.54
HAO1 Q9UJM8 1/20 0.54
PLA2G1B P04054 1/20 0.51
ATG4B Q9Y4P1 1/20 0.51

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
SCHEMBL2356098 0.93 THRA (0.67) RARBTHRATHRBALDH1A1MEN1
SCHEMBL10651489 0.93 THRA (0.67) RARBTHRATHRBALDH1A1MEN1
SCHEMBL2722720 0.93 THRA (0.67) RARBTHRATHRBALDH1A1MEN1
SCHEMBL5547984 0.93 THRA (0.67) RARBTHRATHRBALDH1A1MEN1
SCHEMBL763142 0.91 RARB (0.53) RARBTHRATHRBALDH1A1HPGD
SCHEMBL7587230 0.87 THRB (0.51) RARBTHRATHRBALDH1A1HPGD
SCHEMBL13578977 0.86 THRA (0.55) RARBTHRATHRBALDH1A1MEN1
SCHEMBL5382633 0.86 THRA (0.61) RARBTHRATHRBALDH1A1HPGD
SCHEMBL8620456 0.86 RARB (0.57) RARBTHRATHRBALDH1A1PLK1
SCHEMBL29183250 0.84 THRA (0.58) RARBTHRATHRBALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113493222-A Inorganic oxide nanoparticle dispersion liquid having high transparency, optical film prepared therefrom and member for display 凯斯科技股份有限公司 2021-10-12 CN disclosed