SCHEMBL9764884

SCHEMBL9764884

CNC(=O)N(O)C(c1csc2ccccc12)c1csc2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.57
PKM P14618 1/20 0.43
CMA1 P23946 1/20 0.43
MAPT P10636 3/20 0.41
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41
RAB9A P51151 4/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NPC1 O15118 2/20 0.38

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
SCHEMBL9764863 0.85 ALOX5 (0.53) ALOX5PKMCMA1HDAC3HDAC4
SCHEMBL9764907 0.84 ALOX5 (0.61) ALOX5PKMCMA1MAPTHDAC3
SCHEMBL5691758 0.74 ALOX5 (0.76) ALOX5PKMCMA1MAPTHDAC3
SCHEMBL5689869 0.72 ALOX5 (1.00) ALOX5GAA
SCHEMBL9764875 0.69 ALOX5 (0.48) ALOX5PKMCMA1MAPTHDAC3
SCHEMBL13083671 0.69 ALOX5 (0.54) ALOX5PKMCMA1MAPTHDAC3
SCHEMBL7003003 0.69 ALOX5 (0.57) ALOX5PKMCMA1MAPTHDAC3
SCHEMBL29013450 0.69 ALOX5 (0.57) ALOX5PKMCMA1MAPTHDAC3
SCHEMBL29805312 0.69 ALOX5 (0.57) ALOX5PKMCMA1MAPTHDAC3
SCHEMBL5690322 0.69 PKM (0.54) ALOX5PKMCMA1MAPTHDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0422079-A4 TRICYCLIC LIPOXYGENASE INHIBITING COMPOUNDS, COMPOSITIONS, METHODS OF USE 1991-08-21 EP disclosed
EP-0422079-A1 TRICYCLIC LIPOXYGENASE INHIBITING COMPOUNDS, COMPOSITIONS, METHODS OF USE ABBOTT LABORATORIES (US) 1991-04-17 EP disclosed
WO-1989012636-A1 TRICYCLIC LIPOXYGENASE INHIBITING COMPOUNDS, COMPOSITIONS, METHODS OF USE ABBOTT LABORATORIES (US) 1989-12-28 WO disclosed
EP-0346939-A1 Tricyclic lipoxygenase inhibiting compounds ABBOTT LABORATORIES (US) 1989-12-20 EP disclosed
US-4822811-A Carbazole lipoxygenase inhibiting compounds, compositions and use ABBOTT LABORATORIES (US) 1989-04-18 US disclosed