SCHEMBL10038565

SCHEMBL10038565

Cc1ccccc1-n1ncnc1-c1ccc(Br)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
TSHR P16473 3/20 0.43
MAPT P10636 3/20 0.42
TP53 P04637 1/20 0.42
GAA P10253 1/20 0.42
FLT3 P36888 1/20 0.39
GSK3B P49841 1/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
MAPK1 P28482 2/20 0.39
KDM4E B2RXH2 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
P2RX7 Q99572 2/20 0.37
NR1H2 P55055 2/20 0.37
NR1H3 Q13133 2/20 0.37
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
MAPK14 Q16539 1/20 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
SCHEMBL8512480 0.87 ALDH1A1 (0.56) ALDH1A1TSHRMAPTFLT3GSK3B
SCHEMBL10069065 0.86 ALDH1A1 (0.44) ALDH1A1TSHRMAPTGAAFLT3
SCHEMBL10038564 0.80 ALDH1A1 (0.41) ALDH1A1TSHRMAPTGAAFLT3
SCHEMBL10038571 0.80 ALDH1A1 (0.39) ALDH1A1TSHRMAPTTP53GAA
SCHEMBL24185639 0.71 NPC1 (0.39) ALDH1A1TSHRMAPTTP53GAA
SCHEMBL20732635 0.70 TSHR (0.47) ALDH1A1TSHRMAPTNPC1RAB9A
SCHEMBL11307900 0.70 ALDH1A1 (0.42) ALDH1A1TSHRMAPTTP53GAA
SCHEMBL11303719 0.70 ALDH1A1 (0.42) ALDH1A1TSHRMAPTTP53GAA
SCHEMBL28240672 0.69 MAPT (0.79) ALDH1A1TSHRMAPTTP53GAA
SCHEMBL22530133 0.68 IDO1 (0.38) ALDH1A1TSHRMAPTTP53GAA

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-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