SCHEMBL8035459

SCHEMBL8035459

Oc1ccc2c(c1)SN=CC2

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
PBRM1 Q86U86 1/20 0.32
DRD2 P14416 2/20 0.31
DRD3 P35462 2/20 0.31
DRD1 P21728 1/20 0.31
DRD5 P21918 1/20 0.31
OPRK1 P41145 1/20 0.30

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
SCHEMBL8038664 0.86 DRD2 (0.33) MAOAMAOBDRD2DRD3DRD1
SCHEMBL5430890 0.65 PBRM1 (0.39) MAOAMAOBPBRM1DRD2DRD3
SCHEMBL7493611 0.63 MAOA (0.39) MAOAMAOBPBRM1DRD2DRD3
SCHEMBL30917292 0.63 MAOA (0.39) MAOAMAOBPBRM1DRD2DRD3
SCHEMBL11313006 0.61 MAOA (0.39) MAOAMAOBPBRM1DRD2DRD3
SCHEMBL16685249 0.61 ESR1 (0.36) MAOAMAOBPBRM1DRD2DRD3
SCHEMBL1649615 0.60 PBRM1 (0.32) PBRM1DRD2DRD3DRD1DRD5
SCHEMBL9508302 0.60 MAOA (0.38) MAOAMAOBPBRM1DRD2DRD3
SCHEMBL11603388 0.58 DRD2 (0.42) MAOAMAOBPBRM1DRD2DRD3
SCHEMBL3938438 0.58 DRD2 (0.42) MAOAMAOBPBRM1DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0661039-B1 Oxidative hair dyeing method, composition and kit utilizing hydroxyl substituted benzothiazines BRISTOL MYERS SQUIBB CO (US) 2000-04-05 EP disclosed
EP-0661039-A1 Oxidative hair dyeing method, composition and kit utilizing hydroxyl substituted benzothiazines Bristol-Myers Squibb Company (US) 1995-07-05 EP disclosed
US-5374288-A Oxidative hair dyeing method, composition, and kit utilizing hydroxyl substituted benzothiazines CLAIROL INCORPORATED (US) 1994-12-20 US disclosed