SCHEMBL13429984

SCHEMBL13429984

Sc1ccc(-c2cc(Br)cc(Br)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
IDO1 P14902 2/20 0.33
ESR1 P03372 1/20 0.32
HAO1 Q9UJM8 1/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CRHBP P24387 1/20 0.30
CRHR2 Q13324 1/20 0.30

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
SCHEMBL18748288 0.86 ALDH1A1 (0.45) ALDH1A1MAPK1ESR1MEN1GAA
SCHEMBL2597665 0.80 ALDH1A1 (0.55) ALDH1A1MAPK1ESR1MEN1GAA
SCHEMBL13429760 0.80 ALDH1A1 (0.55) ALDH1A1MAPK1IDO1HAO1MEN1
SCHEMBL30818320 0.80 ESR1 (0.47) ALDH1A1IDO1ESR1HAO1MEN1
SCHEMBL13429765 0.78 RAB9A (0.44) ALDH1A1MAPK1IDO1ESR1MEN1
SCHEMBL13429989 0.78 CHRNB4 (0.32) CHRNB4CHRNA3
SCHEMBL12441029 0.78 CHRNB4 (0.32) CHRNB4CHRNA3
SCHEMBL13429752 0.77 APEX1 (0.60) IDO1ESR1HAO1CRHBPCRHR2
SCHEMBL993217 0.76 APEX1 (0.44) ALDH1A1MAPK1IDO1MEN1GAA
SCHEMBL967694 0.76 IDO1 (0.50) ALDH1A1MAPK1IDO1ESR1HAO1

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-20100069603-A1 METHOD FOR PRODUCING STRUCTURE WHEREIN AROMATIC POLYMER IS BONDED TO BASE, STRUCTURE HAVING AROMATIC POLYMER CHAIN BONDED TO CONDUCTIVE BASE, AND ELECTRONIC DEVICE COMPRISING THE STRUCTURE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-18 US disclosed
US-20100069603-A1 METHOD FOR PRODUCING STRUCTURE WHEREIN AROMATIC POLYMER IS BONDED TO BASE, STRUCTURE HAVING AROMATIC POLYMER CHAIN BONDED TO CONDUCTIVE BASE, AND ELECTRONIC DEVICE COMPRISING THE STRUCTURE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-18 US disclosed
EP-2110398-A1 METHOD FOR PRODUCING STRUCTURE WHEREIN AROMATIC POLYMER IS BONDED TO BASE, STRUCTURE HAVING AROMATIC POLYMER CHAIN BONDED TO CONDUCTIVE BASE, AND ELECTRONIC DEVICE COMPRISING THE STRUCTURE Sumitomo Chemical Company, Limited (JP) 2009-10-21 EP disclosed