SCHEMBL19154083

SCHEMBL19154083

C=C/C=C\C(=C/C=C)C1C(C(=O)O)C(c2ccccc2)C1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ EDNRA P25101 1/20 0.40
▸ GAA P10253 2/20 0.39
▸ FABP7 O15540 7/20 0.38
▸ FABP5 Q01469 6/20 0.38
▸ GRM1 Q13255 2/20 0.38
▸ GRM2 Q14416 1/20 0.38
▸ GRM4 Q14833 1/20 0.38
▸ FABP3 P05413 3/20 0.38
▸ P4HB P07237 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ PPARG P37231 1/20 0.37
▸ TSHR P16473 1/20 0.36

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
SCHEMBL21120130 0.87 POLB (0.44) POLBALDH1A1EDNRAGAAFABP7
SCHEMBL18674093 0.86 POLB (0.45) POLBALDH1A1EDNRAGAAFABP7
SCHEMBL8643008 0.75 POLB (0.64) POLBALDH1A1EDNRAGAAFABP7
SCHEMBL1029251 0.75 POLB (0.64) POLBALDH1A1EDNRAGAAFABP7
SCHEMBL8932091 0.73 POLB (0.62) POLBALDH1A1EDNRAGAAFABP7
SCHEMBL3482659 0.71 HDAC4 (0.61) POLBALDH1A1EDNRAGAAFABP7
SCHEMBL21120223 0.71 POLB (0.70) POLBALDH1A1EDNRAGAAFABP7
SCHEMBL20598122 0.71 POLB (0.70) POLBALDH1A1EDNRAGAAFABP7
SCHEMBL18674152 0.71 POLB (0.70) POLBALDH1A1EDNRAGAAFABP7
SCHEMBL20614651 0.71 POLB (0.70) POLBALDH1A1EDNRAGAAFABP7

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
US-20170204292-A1 DYNAMIC POLYMER MATERIAL FOR 3D PRINTING INTERNATIONAL BUSINESS MACHINES CORPORATION 2017-07-20 — — US disclosed
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