SCHEMBL7264137

SCHEMBL7264137

Brc1nccc(-c2ccccc2)c1Br

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
MAPK1 P28482 3/20 0.43
LRRK2 Q5S007 2/20 0.43
PRKACA P17612 2/20 0.43
JAK2 O60674 2/20 0.43
PRKD3 O94806 2/20 0.43
MAP4K4 O95819 2/20 0.43
IGF1R P08069 2/20 0.43
FGFR1 P11362 2/20 0.43
FLT1 P17948 2/20 0.43
KDR P35968 2/20 0.43
MAPK8 P45983 2/20 0.43
CLK2 P49760 2/20 0.43
JAK3 P52333 2/20 0.43
CDK5 Q00535 2/20 0.43
MAP4K2 Q12851 2/20 0.43
DYRK1A Q13627 2/20 0.43
NTRK3 Q16288 2/20 0.43
NTRK2 Q16620 2/20 0.43
AURKB Q96GD4 2/20 0.43

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
SCHEMBL30446261 0.83 LMNA (0.42) MAPK1FLT1KDRDYRK1ARPS6KA3
SCHEMBL7264203 0.83 ALDH1A1 (0.43) ALDH1A1MAPK1LRRK2PRKACAJAK2
SCHEMBL1683245 0.81 LRRK2 (0.42) ALDH1A1MAPK1LRRK2PRKACAJAK2
SCHEMBL25120690 0.79 RPS6KA3 (0.41) ALDH1A1MAPK1LRRK2PRKACAJAK2
SCHEMBL28175819 0.79 GSK3B (0.45) ALDH1A1MAPK1LRRK2PRKACAJAK2
SCHEMBL28454509 0.79 COMT (0.42) ALDH1A1MAPK1LRRK2PRKACAJAK2
SCHEMBL14975663 0.79 ALDH1A1 (0.45) ALDH1A1MAPK1LRRK2PRKACAJAK2
SCHEMBL15366432 0.79 FGFR1 (0.41) ALDH1A1MAPK1LRRK2PRKACAJAK2
SCHEMBL1203598 0.76 ALDH1A1 (0.50) ALDH1A1MAPK1MAP4K4L3MBTL1
SCHEMBL10900359 0.75 FOLH1 (0.41) ALDH1A1MAPK1LRRK2PRKACAJAK2

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
EP-1006135-B1 Conjugated N-fluoropyridinium salt-containing polymer and use of the same DAIKIN IND LTD (JP) 2003-02-12 EP disclosed
EP-0787719-B1 CONJUGATED N-FLUOROPYRIDINIUM SALT POLYMER AND USE THEREOF DAIKIN IND LTD (JP) 2001-08-16 EP disclosed
EP-1006135-A1 Conjugated N-fluoropyridinium salt-containing polymer and use of the same DAIKIN INDUSTRIES, LIMITED (JP) 2000-06-07 EP disclosed
EP-0787719-A1 CONJUGATED N-FLUOROPYRIDINIUM SALT POLYMER AND USE THEREOF DAIKIN INDUSTRIES, LTD. (JP) 1997-08-06 EP disclosed