SCHEMBL28061856

SCHEMBL28061856

CCc1cccc(Br)c1-c1ccc(O)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.45
GABRB2 P47870 2/20 0.45
ESR1 P03372 7/20 0.41
ESR2 Q92731 4/20 0.41
HSD17B1 P14061 1/20 0.40
SENP1 Q9P0U3 1/20 0.38
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
USP7 Q93009 4/20 0.36
ESRRB O95718 1/20 0.36
ESRRA P11474 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ANPEP P15144 1/20 0.36
DPP4 P27487 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
SCHEMBL10673076 0.87 GABRA1 (0.54) GABRA1GABRB2ESR1ESR2HSD17B1
SCHEMBL27498982 0.80 ESR1 (0.48) ESR1ESR2HSD17B1SENP1MGAM
SCHEMBL159800 0.80 GABRA1 (0.47) GABRA1GABRB2ESR1ESR2HSD17B1
SCHEMBL27579604 0.79 ESR1 (0.46) GABRA1GABRB2ESR1ESR2HSD17B1
SCHEMBL10454627 0.74 GABRA1 (0.59) GABRA1GABRB2ESR1ESR2HSD17B1
SCHEMBL1004778 0.72 GABRA1 (0.70) GABRA1GABRB2
SCHEMBL18541848 0.72 GABRA1 (0.39) GABRA1GABRB2MEN1KMT2A
SCHEMBL28282749 0.71 USP7 (0.43) ESR1ESR2USP7
SCHEMBL28294570 0.71 TTR (0.48) ESR1ESR2MEN1KMT2A
SCHEMBL28329969 0.70 GABRA1 (0.59) GABRA1GABRB2ESR1ESR2HSD17B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106893091-A The manufacture method of polyphenylene oxide 旭化成株式会社 2017-06-27 CN disclosed
CN-103154086-B Polyphenylene oxide powder and polyphenyl ether resin composition ASAHI KASEI CHEMICALS CORP. (JP) 2016-05-04 CN disclosed