SCHEMBL9411366

SCHEMBL9411366

COc1ccc(C(=O)CCC2CCN(C(C)=O)CC2)c(O)c1OC

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HTR4 Q13639 13/20 0.46
▸ ACHE P22303 11/20 0.46
▸ MAPT P10636 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ DRD2 P14416 1/20 0.44
▸ DRD4 P21917 1/20 0.44
▸ QDPR P09417 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ SIGMAR1 Q99720 1/20 0.41

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
SCHEMBL9411589 0.93 MAPT (0.44) HTR4ACHEMAPTTDP1DRD2
SCHEMBL9411299 0.88 MAPT (0.48) MAPTTDP1QDPRALDH1A1L3MBTL1
SCHEMBL9411362 0.87 MAPT (0.42) HTR4ACHEMAPTTDP1DRD2
Acetic Acid SCHEMBL9411324 0.85 MAPT (0.43) HTR4ACHEMAPTTDP1DRD2
SCHEMBL9411321 0.83 HTR4 (0.42) HTR4ACHEDRD2DRD4ALDH1A1
SCHEMBL9411376 0.78 HPGD (0.48) HTR4ACHEMAPTDRD2DRD4
SCHEMBL9411316 0.77 ALDH1A1 (0.41) HTR4ACHEDRD2DRD4QDPR
SCHEMBL4857563 0.75 HTR4 (0.49) HTR4ACHEALDH1A1L3MBTL1
SCHEMBL9411365 0.73 MAPT (0.43) MAPTTDP1QDPRALDH1A1L3MBTL1
SCHEMBL9411506 0.72 HTR4 (0.44) HTR4ACHEDRD2DRD4

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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