SCHEMBL9026070

SCHEMBL9026070

Cc1cc2cc(CBr)ccc2[nH]c1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.54
▸ GRM1 Q13255 1/20 0.44
▸ MAPT P10636 4/20 0.43
▸ HPGD P15428 3/20 0.43
▸ HTT P42858 1/20 0.43
▸ DAO P14920 1/20 0.42
▸ ALDH1A1 P00352 5/20 0.40
▸ KDM4E B2RXH2 4/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.39
▸ HSD17B10 Q99714 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ CASP1 P29466 1/20 0.38
▸ CASP7 P55210 1/20 0.38
▸ GRIN2D O15399 1/20 0.38
▸ GRIN3B O60391 1/20 0.38
▸ GRIN1 Q05586 1/20 0.38
▸ GRIN2A Q12879 1/20 0.38

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
SCHEMBL31159560 0.87 BRD4 (0.54) BRD4MAPTHPGDDAOALDH1A1
SCHEMBL25629589 0.83 BRD4 (0.54) BRD4GRM1MAPTHPGDHTT
SCHEMBL13802346 0.77 BRD4 (0.59) BRD4GRM1MAPTHPGDDAO
SCHEMBL16381141 0.77 DAO (0.68) BRD4GRM1MAPTHPGDDAO
SCHEMBL15230239 0.74 CA12 (0.55) MAPTRXFP1LMNA
SCHEMBL28979258 0.74 BRD4 (0.59) BRD4GRM1HPGDDAOALDH1A1
SCHEMBL7882349 0.74 DAO (0.64) BRD4GRM1MAPTHPGDDAO
SCHEMBL14721573 0.74 CYP2A6 (0.61) BRD4GRM1MAPTHPGDDAO
SCHEMBL9516070 0.73 CDC7 (0.33) MAPTHPGDHTTDAOALDH1A1
SCHEMBL9269640 0.71 AXL (0.64) BRD4MAPTHPGDHTTALDH1A1

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-0667855-A4 SUBSTITUTED ARYLALKYNYL- AND HETEROARYLALKYNYL-N-HYDROXYUREA INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS. ABBOTT LAB (US) 1996-02-21 — — EP disclosed
EP-0667855-A1 SUBSTITUTED ARYLALKYNYL- AND HETEROARYLALKYNYL-N-HYDROXYUREA INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS ABBOTT LABORATORIES (US) 1995-08-23 — — EP disclosed
WO-1994011342-A1 SUBSTITUTED ARYLALKYNYL- AND HETEROARYLALKYNYL-N-HYDROXYUREA INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS ABBOTT LABORATORIES (US) 1994-05-26 — — WO disclosed
WO-1994004528-A1 ETHER-CONTAINING INHIBITORS OF 5-LIPOXYGENASE ABBOTT LABORATORIES (US) 1994-03-03 — — WO disclosed
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