SCHEMBL9764890

SCHEMBL9764890

CC(=NO)c1ccc2c(c1)oc1ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.54
GFER P55789 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54
MAPT P10636 4/20 0.53
KDM4E B2RXH2 4/20 0.53
RAB9A P51151 4/20 0.53
HPGD P15428 4/20 0.53
NPC1 O15118 3/20 0.53
ALDH1A1 P00352 2/20 0.53
LMNA P02545 2/20 0.53
NPSR1 Q6W5P4 1/20 0.53
HTR2B P41595 1/20 0.52
TTR P02766 1/20 0.50
CYP2D6 P10635 1/20 0.49
CYP2C19 P33261 1/20 0.49
AHR P35869 2/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46

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
SCHEMBL8606853 0.90 CASP3 (0.58) CASP3GFERSENP8SENP7SENP6
SCHEMBL3066189 0.80 HTR2B (0.60) MAPTKDM4ERAB9AHPGDNPC1
SCHEMBL3066186 0.80 HTR2B (0.60) MAPTKDM4ERAB9AHPGDNPC1
SCHEMBL23869908 0.79 TTR (0.53) MAPTKDM4ERAB9AHPGDNPC1
SCHEMBL24178262 0.79 TTR (0.53) MAPTKDM4ERAB9AHPGDNPC1
SCHEMBL7110522 0.79 NPC1 (0.69) MAPTKDM4ERAB9AHPGDNPC1
SCHEMBL24443143 0.79 HTR2B (0.49) MAPTKDM4ERAB9AHPGDNPC1
SCHEMBL24443142 0.78 TTR (0.46) MAPTKDM4ERAB9AHPGDNPC1
SCHEMBL24443224 0.78 TTR (0.46) MAPTKDM4ERAB9AHPGDNPC1
SCHEMBL23229541 0.78 TTR (0.51) MAPTKDM4ERAB9AHPGDNPC1

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-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
US-4769387-A Dibenzofuran lipoxygenase inhibiting compounds, compositions and use ABBOTT LABORATORIES (US) 1988-09-06 US disclosed