SCHEMBL9834288

SCHEMBL9834288

NC(=O)N(O)CCc1ccc(COCc2ccccc2)o1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 11/20 0.59
TSHR P16473 1/20 0.40
DAO P14920 1/20 0.39
HTR2B P41595 1/20 0.39
SLC1A1 P43005 3/20 0.38
SLC1A3 P43003 2/20 0.38
SLC1A2 P43004 2/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL9834151 0.83 ALOX5 (0.47) ALOX5
SCHEMBL9832067 0.83 ALOX5 (0.45) ALOX5
SCHEMBL9832912 0.80 ALOX5 (0.43) ALOX5TSHRMEN1CYP1A2CYP2C19
SCHEMBL9833394 0.75 ALOX5 (0.74) ALOX5TSHRCYP1A2CYP2D6CYP2C9
SCHEMBL8807135 0.74 ALOX5 (1.00) ALOX5
SCHEMBL9379875 0.74 ALOX5 (0.53) ALOX5DAOHTR2BALDH1A1
SCHEMBL9379872 0.74 ALOX5 (0.53) ALOX5DAOHTR2BALDH1A1
SCHEMBL9538830 0.73 ALOX5 (0.65) ALOX5CYP2D6CYP2C9CYP2C19ALDH1A1
SCHEMBL9831016 0.73 ALOX5 (0.42) ALOX5
SCHEMBL9833184 0.72 ALOX5 (0.51) ALOX5ALDH1A1

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
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