SCHEMBL9762032

SCHEMBL9762032

CC(=O)c1ccc(Oc2ccc(Br)cc2F)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.53
HPGD P15428 2/20 0.53
RAB9A P51151 2/20 0.53
MAOB P27338 6/20 0.47
PARP10 Q53GL7 1/20 0.44
MAOA P21397 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 2/20 0.42
ALDH1A1 P00352 2/20 0.42
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ESRRA P11474 1/20 0.41
IGFBP3 P17936 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL30356696 0.84 MAOB (0.58) MAPTHPGDRAB9AMAOBPARP10
SCHEMBL11548018 0.84 MAOB (0.58) MAPTHPGDRAB9AMAOBPARP10
SCHEMBL9761752 0.82 PARP10 (0.49) MAPTHPGDRAB9APARP10LMNA
SCHEMBL756150 0.82 MAPT (0.53) MAPTHPGDRAB9AMAOBPARP10
SCHEMBL3366867 0.81 ALDH1A1 (0.55) MAPTHPGDRAB9AMAOBPARP10
SCHEMBL31751010 0.80 MAPT (0.47) MAPTHPGDRAB9AMAOBMAOA
SCHEMBL9762786 0.79 IGFBP3 (0.42) MAPTHPGDRAB9APARP10SMN1; SMN2
SCHEMBL10437241 0.79 PARP10 (0.46) MAPTPARP10SMN1; SMN2ALDH1A1KMT2A
SCHEMBL9762780 0.79 MEN1 (0.45) MAPTHPGDSMN1; SMN2LMNAALDH1A1
SCHEMBL22158823 0.79 MAPT (0.53) MAPTHPGDRAB9AMAOBPARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5012017-A Peroxide oxidation of halogenated phenoxyphenones to phenoxyophenyl esters, then conversions to phenoxyphenols DOWELANCO (US) 1991-04-30 US disclosed
CN-1034917-A The preparation method of (phenoxy group phenoxy group) propionic acid ester DOW CHEMICAL CO (US) 1989-08-23 CN disclosed
WO-1989006227-A1 PHENOXYPHENOXYPROPIONATES, INTERMEDIATES THEREOF AND METHODS OF PREPARATION THE DOW CHEMICAL COMPANY (US) 1989-07-13 WO disclosed
EP-0322983-A1 Phenoxyphenoxypropionates, intermediates thereof and methods of preparation THE DOW CHEMICAL COMPANY (US) 1989-07-05 EP disclosed