SCHEMBL6010852

SCHEMBL6010852

Clc1cc(NCc2ccccc2)c2oc(N3CCCNCC3)nc2c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 8/20 0.48
MAOB P27338 5/20 0.48
PDE4A P27815 4/20 0.42
PDE4B Q07343 4/20 0.42
PDE4C Q08493 4/20 0.42
PDE4D Q08499 4/20 0.42
ACHE P22303 1/20 0.41
CXCR4 P61073 1/20 0.40
ROCK1 Q13464 1/20 0.38
CHEK1 O14757 1/20 0.38
NCF1 P14598 1/20 0.38

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
SCHEMBL6010844 0.85 CHRNB2 (0.38) HTR6MAOBCXCR4NCF1
SCHEMBL6010809 0.81 F10 (0.44) HTR6NCF1
Hydrochloric Acid SCHEMBL6010656 0.80 F10 (0.43) HTR6NCF1
SCHEMBL6010815 0.78 CHRNB2 (0.39) HTR6
SCHEMBL6010820 0.77 HRH4 (0.46) HTR6NCF1
SCHEMBL6010862 0.77 HTR6 (0.40) HTR6
Hydrochloric Acid SCHEMBL6010978 0.76 HTR6 (0.39) HTR6
SCHEMBL6010864 0.76 CHRNB2 (0.43) HTR6NCF1
SCHEMBL6010738 0.75 HRH4 (0.45) HTR6
SCHEMBL4158366 0.75 CHRNB2 (0.42) HTR6NCF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1134220-A1 BENZOXAZOLE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2001-09-19 EP claimed
US-7045516-B1 Benzoxazole derivatives and drugs containing the same as the active ingredient KOICHI SHUDO (JP) 2006-05-16 US disclosed
EP-1134220-B1 BENZOXAZOLE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT SHUDO KOICHI (JP) 2004-08-18 EP disclosed
EP-1134220-A1 BENZOXAZOLE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2001-09-19 EP disclosed