SCHEMBL9411206

SCHEMBL9411206

Cc1ccc2on(CCC3CCN(CCc4ccccc4)CC3)c(=O)c2c1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 0.50
▸ CCR3 P51677 1/20 0.45
▸ MAOB P27338 2/20 0.45
▸ HRH1 P35367 1/20 0.45
▸ MAOA P21397 1/20 0.44
▸ CARM1 Q86X55 1/20 0.43
▸ PRMT6 Q96LA8 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43

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
Fumaric Acid SCHEMBL9411356 0.94 ACHE (0.45) ACHEMAOBHRH1MEN1KMT2A
Fumaric Acid SCHEMBL9411360 0.94 ACHE (0.45) ACHEMAOBHRH1MEN1KMT2A
SCHEMBL9411434 0.92 MAOA (0.46) ACHECCR3MAOBHRH1MAOA
SCHEMBL9411391 0.91 ACHE (0.58) ACHEMAOB
SCHEMBL9411638 0.90 HTR1A (0.43) ACHE
SCHEMBL9411377 0.88 ACHE (0.49) ACHECCR3
SCHEMBL9411236 0.86 MAOA (0.45) ACHECCR3MAOBHRH1MAOA
Fumaric Acid SCHEMBL9411463 0.86 ACHE (0.45) ACHEMAOBHRH1MAOAMEN1
Fumaric Acid SCHEMBL9411459 0.86 ACHE (0.45) ACHEMAOBHRH1MAOAMEN1
SCHEMBL9411647 0.82 ACHE (0.53) ACHEMAOBMAOAMEN1KMT2A

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