SCHEMBL10038575

SCHEMBL10038575

O=CNC(=O)c1ccc(Br)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OGG1 O15527 1/20 0.57
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
ALDH1A1 P00352 3/20 0.49
MAPT P10636 3/20 0.49
CA12 O43570 1/20 0.48
MMP2 P08253 1/20 0.48
CA14 Q9ULX7 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
KDM4E B2RXH2 1/20 0.47
GAA P10253 1/20 0.47
GFER P55789 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
POLB P06746 4/20 0.46
HDAC3 O15379 1/20 0.46

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
SCHEMBL15258016 0.89 HPGD (0.47) OGG1ALDH1A1MAPTCA12SMN1; SMN2
SCHEMBL31030766 0.81 OGG1 (0.55) OGG1CES2CES1ALDH1A1MAPT
SCHEMBL8681380 0.79 ALDH1A1 (0.57) OGG1ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL6744163 0.78 MEN1 (0.52) CES2CES1SMN1; SMN2GAACA1
SCHEMBL28339402 0.78 HPGD (0.63) CES2CES1ALDH1A1SMN1; SMN2TDP1
SCHEMBL27668460 0.78 LMNA (0.55) ALDH1A1MAPTCA12SMN1; SMN2TDP1
SCHEMBL5060811 0.78 ALDH1A1 (0.57) CES2CES1ALDH1A1MAPTSMN1; SMN2
SCHEMBL12514716 0.78 ALDH1A1 (0.56) ALDH1A1MAPTSMN1; SMN2KDM4EKMT2A
SCHEMBL25073188 0.78 HPGD (0.68) OGG1CES2CES1ALDH1A1MAPT
SCHEMBL554490 0.77 RAB9A (0.59) CES2CES1ALDH1A1MAPTCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107082761-A Phenanthridone or benzo phenanthridines ketone derivatives and its synthetic method 上海大学 2017-08-22 CN disclosed
US-9673405-B2 Organic electroluminescent device, display apparatus, and lighting apparatus KONICA MINOLTA HOLDINGS, INC. (JP) 2017-06-06 US disclosed
US-9673405-B2 Organic electroluminescent device, display apparatus, and lighting apparatus KONICA MINOLTA HOLDINGS, INC. (JP) 2017-06-06 US disclosed
US-20120018714-A1 ORGANIC ELECTROLUMINESCENT DEVICE, DISPLAY APPARATUS, AND LIGHTING APPARATUS KONICA MINOLTA HOLDINGS, INC. (JP) 2012-01-26 US disclosed
US-20120018714-A1 ORGANIC ELECTROLUMINESCENT DEVICE, DISPLAY APPARATUS, AND LIGHTING APPARATUS KONICA MINOLTA HOLDINGS, INC. (JP) 2012-01-26 US disclosed