SCHEMBL9832797

SCHEMBL9832797

Cc1ccc(CCN(O)C(=O)c2ccc(S(C)(=O)=O)cc2)o1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.43
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
GSR P00390 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.38
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36

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
SCHEMBL9832426 0.76 ALOX5 (0.71) ALOX5KMT2AMEN1ALDH1A1KDM4E
SCHEMBL9730349 0.71 ALOX5 (0.55) ALOX5KMT2AGSRSMN1; SMN2
SCHEMBL3192132 0.69 MCHR1 (0.52) ALOX5ALDH1A1TSHR
Tetrabuthylammonium SCHEMBL9833807 0.66 ALOX5 (0.55) ALOX5KMT2AMEN1ALDH1A1KDM4E
SCHEMBL9831966 0.66 MAPT (0.48) ALOX5KMT2AMEN1ALDH1A1KDM4E
SCHEMBL11657126 0.65 GSR (0.56) KMT2AMEN1ALDH1A1GSRSMN1; SMN2
SCHEMBL12220052 0.65 L3MBTL1 (0.68) KMT2AMEN1ALDH1A1GSRSMN1; SMN2
SCHEMBL6992415 0.65 MEN1 (0.47) ALOX5KMT2AMEN1ALDH1A1KDM4E
SCHEMBL9832106 0.64 ALOX5 (0.53) ALOX5KMT2AMEN1ALDH1A1KDM4E
SCHEMBL9542469 0.64 ALOX5 (0.60) ALOX5KMT2AMEN1ALDH1A1KDM4E

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