SCHEMBL9411647

SCHEMBL9411647

Cc1ccc2c(=O)n(CCC3CCN(Cc4ccccc4)CC3)oc2c1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 11/20 0.53
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ MAOB P27338 3/20 0.51
▸ BCHE P06276 1/20 0.51
▸ MAOA P21397 1/20 0.47

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
SCHEMBL9411391 0.92 ACHE (0.58) ACHEMAOBBCHE
SCHEMBL9411434 0.91 MAOA (0.46) ACHEMEN1KMT2AMAOBMAOA
SCHEMBL9411661 0.89 ACHE (0.47) ACHEMEN1KMT2AMAOBBCHE
SCHEMBL9411302 0.88 ACHE (0.50) ACHE
SCHEMBL9411292 0.85 ACHE (0.47) ACHEMEN1KMT2A
SCHEMBL9411236 0.85 MAOA (0.45) ACHEMEN1KMT2AMAOBMAOA
Fumaric Acid SCHEMBL9411459 0.85 ACHE (0.45) ACHEMEN1KMT2AMAOBBCHE
Fumaric Acid SCHEMBL9411463 0.85 ACHE (0.45) ACHEMEN1KMT2AMAOBBCHE
SCHEMBL9411206 0.82 ACHE (0.50) ACHEMEN1KMT2AMAOBMAOA
SCHEMBL9411276 0.82 ACHE (0.58) ACHE

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
EP-0602242-A1 BENZISOXAZOLE COMPOUND AND USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-06-22 — — EP disclosed
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