SCHEMBL9762786

SCHEMBL9762786

O=C(c1ccc(Oc2ccc(Br)cc2F)cc1)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGFBP3 P17936 2/20 0.42
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
SRD5A2 P31213 1/20 0.41
PARP10 Q53GL7 1/20 0.40
SCN9A Q15858 1/20 0.39
LGALS8 O00214 1/20 0.39
LGALS3 P17931 1/20 0.39
KCNQ3 O43525 1/20 0.38
KCNQ2 O43526 1/20 0.38
KCNE1 P15382 1/20 0.38
KCNQ1 P51787 1/20 0.38
HPGD P15428 1/20 0.38
CNR1 P21554 2/20 0.38

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
SCHEMBL9763016 0.86 SCN9A (0.38) IGFBP3MAPTKMT2ASCN9ALGALS8
SCHEMBL9761752 0.85 PARP10 (0.49) IGFBP3LMNAMEN1MAPTMAPK1
SCHEMBL9762032 0.79 MAPT (0.53) IGFBP3LMNAMAPTMAPK1RAB9A
SCHEMBL10437241 0.74 PARP10 (0.46) MEN1MAPTKMT2APARP10KCNQ3
SCHEMBL9762780 0.74 MEN1 (0.45) LMNAMEN1MAPTMAPK1KMT2A
SCHEMBL9860205 0.73 LMNA (0.53) LMNAMEN1MAPTMAPK1RAB9A
SCHEMBL812018 0.72 SRD5A2 (0.66) SRD5A2PARP10HPGDCNR1CNR2
SCHEMBL9762927 0.72 KMT2A (0.47) MEN1MAPTRAB9AKMT2APARP10
SCHEMBL10562013 0.71 FPR2 (0.40) LMNAMEN1RAB9AKMT2ASCN9A
SCHEMBL756150 0.71 MAPT (0.53) IGFBP3LMNAMAPTRAB9APARP10

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
US-5012017-A Peroxide oxidation of halogenated phenoxyphenones to phenoxyophenyl esters, then conversions to phenoxyphenols DOWELANCO (US) 1991-04-30 US 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