SCHEMBL9833394

SCHEMBL9833394

NC(=O)N(O)CCc1ccc(-c2ccccc2)o1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.74
ALDH1A1 P00352 6/20 0.59
MAPT P10636 4/20 0.59
PKM P14618 4/20 0.59
HSD17B10 Q99714 2/20 0.59
HTT P42858 2/20 0.59
POLB P06746 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
CYP2C19 P33261 2/20 0.50
CYP2E1 P05181 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2A6 P11509 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2B6 P20813 1/20 0.50
HPGD P15428 3/20 0.48
TSHR P16473 1/20 0.48
PPARG P37231 1/20 0.48
NCOA2 Q15596 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL9832196 0.85 ALDH1A1 (0.59) ALOX5ALDH1A1MAPTPKMHSD17B10
SCHEMBL8806200 0.85 ALOX5 (1.00) ALOX5ALDH1A1MAPTPKMHSD17B10
SCHEMBL9538830 0.82 ALOX5 (0.65) ALOX5ALDH1A1MAPTPKMHSD17B10
SCHEMBL9832972 0.82 ALDH1A1 (0.55) ALOX5ALDH1A1MAPTPKMHSD17B10
SCHEMBL9832832 0.80 ALOX5 (0.54) ALOX5
SCHEMBL9834151 0.79 ALOX5 (0.47) ALOX5HRH1
SCHEMBL14654432 0.78 ALDH1A1 (0.76) ALOX5ALDH1A1MAPTPKMHSD17B10
SCHEMBL8810226 0.76 ALOX5 (1.00) ALOX5ALDH1A1MAPTPKMHSD17B10
SCHEMBL9833184 0.76 ALOX5 (0.51) ALOX5ALDH1A1MAPTHPGDNPSR1
SCHEMBL9831384 0.75 ALOX5 (0.45) ALOX5HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0388429-A4 FURAN AND PYRROLE CONTAINING LIPOXYGENASE INHIBITING COMPOUNDS 1991-08-21 EP claimed
EP-0388429-A1 FURAN AND PYRROLE CONTAINING LIPOXYGENASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1990-09-26 EP claimed
WO-1989004299-A1 FURAN AND PYRROLE CONTAINING LIPOXYGENASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1989-05-18 WO claimed
EP-0388429-A4 FURAN AND PYRROLE CONTAINING LIPOXYGENASE INHIBITING COMPOUNDS 1991-08-21 EP disclosed
EP-0388429-A1 FURAN AND PYRROLE CONTAINING LIPOXYGENASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1990-09-26 EP disclosed
WO-1989004299-A1 FURAN AND PYRROLE CONTAINING LIPOXYGENASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1989-05-18 WO disclosed