SCHEMBL28091016

SCHEMBL28091016

Brc1cc2c(sc3c4c5ccccc5sc4c4c5ccccc5sc4c23)c(Br)c1Br

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.48
PTPRC P08575 1/20 0.39
PTPRF P10586 1/20 0.39
PTPRA P18433 1/20 0.39
PTPRB P23467 1/20 0.39
PTPN6 P29350 1/20 0.39
DUSP3 P51452 1/20 0.39
PTPN12 Q05209 1/20 0.39
GPR3 P46089 1/20 0.39
MAPT P10636 4/20 0.38
TNKS O95271 2/20 0.38
TNKS2 Q9H2K2 2/20 0.38
MEN1 O00255 2/20 0.35
RAB9A P51151 2/20 0.35
KMT2A Q03164 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
ATM Q13315 1/20 0.35
ALDH1A1 P00352 4/20 0.33
HPGD P15428 2/20 0.33
HCRTR1 O43613 2/20 0.33

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
SCHEMBL17010959 0.79 GPR3 (0.60) PTPN1DUSP3GPR3MAPTTNKS
SCHEMBL16867080 0.79 PTPN1 (0.47) PTPN1PTPRCPTPRFPTPRAPTPRB
SCHEMBL21187004 0.77 PTPN1 (0.46) PTPN1PTPRCPTPRFPTPRAPTPRB
SCHEMBL22172094 0.75 PTPN1 (0.50) PTPN1PTPRCPTPRFPTPRAPTPRB
SCHEMBL25620893 0.75 TNKS (0.41) PTPN1PTPRCPTPRFPTPRAPTPRB
SCHEMBL14951318 0.74 PTPN1 (0.46) PTPN1PTPRCPTPRFPTPRAPTPRB
SCHEMBL15003463 0.74 PTPN1 (0.46) PTPN1PTPRCPTPRFPTPRAPTPRB
SCHEMBL30885073 0.72 PTPN1 (0.46) PTPN1PTPRCPTPRFPTPRAPTPRB
SCHEMBL17252906 0.72 PTPN1 (0.46) PTPN1PTPRCPTPRFPTPRAPTPRB
SCHEMBL30038579 0.72 PTPN1 (0.46) PTPN1PTPRCPTPRFPTPRAPTPRB

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
CN-105859507-A Organic photoelectric material and use thereof 机光科技股份有限公司 2016-08-17 CN disclosed