SCHEMBL9764854

SCHEMBL9764854

CCCCON(C(N)=O)C(C)(c1coc2ccccc12)c1coc2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.40
MAPT P10636 3/20 0.35
LMNA P02545 2/20 0.34
CA2 P00918 1/20 0.34
ALDH1A1 P00352 1/20 0.34
F2 P00734 1/20 0.34
MIF P14174 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP1A2 P05177 2/20 0.34
HPGD P15428 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
MTNR1A P48039 1/20 0.34
HTT P42858 1/20 0.33
FAAH O00519 1/20 0.33
MGLL Q99685 1/20 0.33
MAOA P21397 1/20 0.33
KDM5A P29375 1/20 0.33

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
SCHEMBL10593829 0.83 MAOB (0.39) MAOBMAPTLMNACA2ALDH1A1
SCHEMBL10559546 0.77 ALOX5 (0.39) MAPTALDH1A1HSD17B10CYP1A2HPGD
SCHEMBL9764908 0.75 MAOB (0.39) MAOBMAPTCA2ALDH1A1HTT
SCHEMBL9764896 0.74 MAOB (0.38) MAOBMAPTCA2ALDH1A1HTT
SCHEMBL9764828 0.73 MAOB (0.40) MAOBMAPTCYP1A2HPGDCYP3A4
SCHEMBL9764879 0.72 CA2 (0.39) MAOBMAPTCA2ALDH1A1KMT2A
SCHEMBL9764903 0.72 MAOB (0.42) MAOBMAPTLMNACA2L3MBTL1
SCHEMBL9764894 0.72 MAOB (0.36) MAOBMAPTMAOA
SCHEMBL10555909 0.71 MAOB (0.37) MAOBMAPTLMNACA2ALDH1A1
SCHEMBL9764872 0.69 MAOB (0.39) MAOBMAPTCA2ALDH1A1KMT2A

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