SCHEMBL11199568

SCHEMBL11199568

CC(CCOCc1ccccc1Br)(Oc1ccc(O)cc1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PARP10 Q53GL7 1/20 0.43
▸ PPARG P37231 7/20 0.42
▸ PPARA Q07869 5/20 0.42
▸ FFAR1 O14842 1/20 0.41
▸ FFAR4 Q5NUL3 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.39
▸ CHRM3 P20309 1/20 0.37
▸ MAPT P10636 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ELANE P08246 1/20 0.36
▸ RIPK1 Q13546 1/20 0.35
▸ ADORA3 P0DMS8 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ IDO1 P14902 1/20 0.35

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
SCHEMBL10639678 0.88 MAOB (0.44) PPARGPPARAFFAR1CHRM3ELANE
SCHEMBL10635993 0.87 MAOB (0.45) PARP10PPARGPPARAALDH1A1CHRM3
SCHEMBL10636695 0.87 PPARA (0.47) PPARGPPARAMAPTRAB9AKMT2A
SCHEMBL11193871 0.86 L3MBTL1 (0.42) PARP10PPARGPPARAALDH1A1MAPT
SCHEMBL11020458 0.85 PPARG (0.51) PARP10PPARGPPARAFFAR1ALDH1A1
SCHEMBL10636207 0.85 PPARG (0.52) PPARGPPARA
SCHEMBL10712455 0.83 ADORA3 (0.43) PPARGPPARAALDH1A1MAPTKMT2A
SCHEMBL11199788 0.83 MAOB (0.49) PPARGPPARAALDH1A1MAPTKMT2A
SCHEMBL11199783 0.83 MAOB (0.49) PPARGPPARAALDH1A1MAPTKMT2A
SCHEMBL10633515 0.82 PPARG (0.50) PPARGPPARA

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
EP-0068260-A2 Substituted phenoxypropionates, process for their preparation and their use as herbicides NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1983-01-05 — — EP disclosed
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