SCHEMBL17454724

SCHEMBL17454724

CN1N=C(c2cccc(-c3ccccc3)c2)CC1c1ccccc1

nearest known ligand 0.82

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 17/20 0.82
▸ MAOA P21397 11/20 0.82
▸ KIF11 P52732 1/20 0.52
▸ KDM4E B2RXH2 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ LMNA P02545 1/20 0.49

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
SCHEMBL31429939 0.90 MAOB (1.00) MAOBMAOA
SCHEMBL7456837 0.88 MAOB (0.73) MAOBMAOAKIF11
SCHEMBL7461031 0.82 MAOB (0.73) MAOBMAOAKIF11
SCHEMBL14081500 0.81 MAOB (1.00) MAOBMAOA
SCHEMBL14081504 0.81 MAOB (0.88) MAOBMAOA
SCHEMBL7463306 0.74 MAOB (0.52) MAOBMAOA
SCHEMBL11713041 0.74 MEN1 (0.69) MAOBMAOA
SCHEMBL11495713 0.74 MAOB (0.68) MAOBMAOA
SCHEMBL9626269 0.74 PDE5A (0.71) MAOBMAOAKDM4EALDH1A1LMNA
SCHEMBL6294055 0.74 MAOB (0.71) MAOBMAOAKDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016010402-A1 ORGANIC ELECTROLUMINESCENT DEVICE ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2016-01-21 — — WO disclosed
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