SCHEMBL9832102

SCHEMBL9832102

Cc1ccc(CCN(N)C(=O)NO)o1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.45
POLB P06746 2/20 0.42
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
PKM P14618 2/20 0.41
MAPT P10636 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TSHR P16473 2/20 0.39
HPGD P15428 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL9832959 0.83 ALOX5 (0.50) ALOX5POLBALDH1A1MEN1KMT2A
SCHEMBL9832426 0.73 ALOX5 (0.71) ALOX5POLBALDH1A1MEN1KMT2A
SCHEMBL9832106 0.73 ALOX5 (0.53) ALOX5POLBALDH1A1MEN1KMT2A
Hydroxyurea SCHEMBL9833420 0.72 ALOX5 (0.47) ALOX5POLBALDH1A1MEN1KMT2A
SCHEMBL3577399 0.72 ALOX5 (0.44) ALOX5POLBALDH1A1MEN1KMT2A
SCHEMBL9831966 0.69 MAPT (0.48) ALOX5POLBALDH1A1MEN1KMT2A
SCHEMBL30274855 0.68 ALOX5 (0.54) ALOX5POLBALDH1A1MEN1KMT2A
SCHEMBL6475097 0.68 CHRM2 (0.58) ALOX5POLBALDH1A1MEN1KMT2A
SCHEMBL9830854 0.68 CHRM2 (0.47) ALOX5POLBALDH1A1MEN1KMT2A
SCHEMBL4138469 0.68 MAPT (0.56) ALOX5POLBALDH1A1MEN1KMT2A

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