SCHEMBL9132166

SCHEMBL9132166

CCN(CC)c1ccc(-c2cc3ccccc3o2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.57
KDM4E B2RXH2 1/20 0.54
MEN1 O00255 1/20 0.54
NPC1 O15118 1/20 0.54
ALDH1A1 P00352 1/20 0.54
NFKB1 P19838 1/20 0.54
NPY1R P25929 1/20 0.54
RAB9A P51151 1/20 0.54
NFKB2 Q00653 1/20 0.54
KMT2A Q03164 1/20 0.54
RELA Q04206 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
ALOX5 P09917 1/20 0.50
P2RY14 Q15391 1/20 0.47
MAOA P21397 1/20 0.46
HCRTR1 O43613 1/20 0.46
MAPT P10636 1/20 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
SCHEMBL13475658 0.85 MAOB (0.66) MAOBKDM4EMEN1NPC1ALDH1A1
SCHEMBL24368356 0.83 MAOB (0.64) MAOBKDM4EMEN1NPC1ALDH1A1
SCHEMBL24368733 0.83 MAOB (0.64) MAOBKDM4EMEN1NPC1ALDH1A1
SCHEMBL24368355 0.83 MAOB (0.64) MAOBKDM4EMEN1NPC1ALDH1A1
SCHEMBL26255497 0.82 MAOB (0.62) MAOBKDM4EMEN1NPC1ALDH1A1
SCHEMBL9133017 0.82 APP (0.65) MAOBKDM4EMEN1NPC1ALDH1A1
SCHEMBL21860430 0.82 CYP19A1 (0.48) MAOBKDM4EMEN1ALDH1A1RAB9A
SCHEMBL24368920 0.81 MAOB (0.60) MAOBKDM4EMEN1NPC1ALDH1A1
SCHEMBL24368922 0.81 MAOB (0.60) MAOBKDM4EMEN1NPC1ALDH1A1
SCHEMBL24368776 0.81 MAOB (0.60) MAOBKDM4EMEN1NPC1ALDH1A1

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
US-5468470-A Radiation resistance and sunscreen agents 3V INC. (US) 1995-11-21 US claimed
EP-0613893-A1 Benzofuran derivatives and the use thereof as stabilizers against UV radiations 3V SIGMA S.p.A (IT) 1994-09-07 EP claimed
CN-108699019-A Benzofuran derivatives useful in the treatment of central nervous system and other diseases 华纳巴布科克绿色化学学院有限公司 2018-10-23 CN disclosed
US-5468470-A Radiation resistance and sunscreen agents 3V INC. (US) 1995-11-21 US disclosed
US-5362481-A Useful in cosmetics and dermatology 3V INC. (US) 1994-11-08 US disclosed
EP-0613893-A1 Benzofuran derivatives and the use thereof as stabilizers against UV radiations 3V SIGMA S.p.A (IT) 1994-09-07 EP disclosed