SCHEMBL8807659

SCHEMBL8807659

CC(=O)c1ccc(OC(=O)NCc2ccccc2)o1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.49
RAB9A P51151 1/20 0.49
ALDH1A1 P00352 2/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
BCHE P06276 2/20 0.45
NCEH1 Q6PIU2 1/20 0.45
HPGD P15428 1/20 0.44
PTPN1 P18031 1/20 0.44

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
SCHEMBL18511929 0.77 HPGD (0.67) NPC1RAB9AALDH1A1HTTSMN1; SMN2
SCHEMBL27791058 0.74 KMT2A (0.46) NPC1RAB9AALDH1A1HTTSMN1; SMN2
SCHEMBL17552096 0.73 NPC1 (0.69) NPC1RAB9AALDH1A1HTTNCEH1
SCHEMBL5108159 0.73 NPC1 (0.69) NPC1RAB9AALDH1A1HTTNCEH1
SCHEMBL1720194 0.72 ALDH1A1 (0.67) NPC1ALDH1A1SMN1; SMN2BCHEHPGD
SCHEMBL1249499 0.72 KDM4E (0.39) ALDH1A1SMN1; SMN2HPGD
SCHEMBL9655074 0.72 NPC1 (0.52) NPC1RAB9AALDH1A1SMN1; SMN2NCEH1
SCHEMBL14080775 0.72 RAB9A (0.68) NPC1RAB9AALDH1A1HTT
SCHEMBL28058232 0.71 BCHE (0.55) ALDH1A1SMN1; SMN2BCHENCEH1HPGD
SCHEMBL30776776 0.71 NPC1 (0.67) NPC1RAB9AALDH1A1HTTNCEH1

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-0320628-B1 Substituted furan compounds which are useful in inhibiting lipoxygenase enzymes, particularly 5-lipoxygenase ABBOTT LAB (US) 1997-01-15 EP disclosed
US-5112848-A Antiasthmatics and antiarthritic agents ABBOTT LABORATORIES (US) 1992-05-12 US disclosed
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
EP-0320628-A1 Substituted furan compounds which are useful in inhibiting lipoxygenase enzymes, particularly 5-lipoxygenase ABBOTT LABORATORIES (US) 1989-06-21 EP disclosed
WO-1989004299-A1 FURAN AND PYRROLE CONTAINING LIPOXYGENASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1989-05-18 WO disclosed