SCHEMBL27765010

SCHEMBL27765010

CCCCCCN1c2ccccc2Sc2cc(C=C(C#N)C#N)ccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDF Q9HBH1 2/20 0.47
▸ KDM1A O60341 7/20 0.44
▸ PIM1 P11309 1/20 0.43
▸ CHRM2 P08172 2/20 0.41
▸ HTR1A P08908 2/20 0.41
▸ ADRA2A P08913 2/20 0.41
▸ CHRM1 P11229 2/20 0.41
▸ DRD1 P21728 2/20 0.41
▸ SLC6A2 P23975 2/20 0.41
▸ SLC6A4 P31645 2/20 0.41
▸ ADRA1A P35348 2/20 0.41
▸ OPRM1 P35372 2/20 0.41
▸ DRD3 P35462 2/20 0.41
▸ KCNH2 Q12809 2/20 0.41
▸ TP53 P04637 2/20 0.41
▸ CYP1A2 P05177 2/20 0.41
▸ CYP2D6 P10635 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ THPO P40225 2/20 0.41
▸ MTOR P42345 2/20 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
SCHEMBL17226390 0.89 PDF (0.45) PDFKDM1APIM1CHRM2HTR1A
SCHEMBL22292242 0.86 MAPT (0.45) KDM1ATP53CYP1A2CYP2D6TSHR
SCHEMBL31174404 0.82 PDF (0.53) PDFKDM1APIM1CHRM2HTR1A
SCHEMBL28910976 0.82 PDF (0.50) PDFKDM1APIM1CHRM2HTR1A
SCHEMBL28910941 0.82 PDF (0.50) PDFKDM1APIM1CHRM2HTR1A
SCHEMBL28910953 0.82 PDF (0.50) PDFKDM1APIM1CHRM2HTR1A
SCHEMBL28910950 0.82 PDF (0.50) PDFKDM1APIM1CHRM2HTR1A
SCHEMBL27788286 0.80 PDF (0.47) PDFKDM1APIM1CHRM2HTR1A
SCHEMBL30445358 0.79 PDF (0.54) PDFKDM1APIM1CHRM2HTR1A
SCHEMBL16488357 0.79 PDF (0.43) PDFKDM1ATP53CYP1A2CYP2D6

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
CN-101602746-B Preparation and application of 3-substituted-N-hexyl phenothiazine derivative UNIV HUAZHONG NORMAL 2012-10-10 — — CN claimed
CN-101602746-A The preparation and the application thereof of 3-replacement-N-hexyl phenothiazine derivative UNIV HUAZHONG NORMAL (CN) 2009-12-16 — — CN claimed
CN-101602746-B Preparation and application of 3-substituted-N-hexyl phenothiazine derivative UNIV HUAZHONG NORMAL 2012-10-10 — — CN disclosed
CN-101602746-A The preparation and the application thereof of 3-replacement-N-hexyl phenothiazine derivative UNIV HUAZHONG NORMAL (CN) 2009-12-16 — — CN disclosed
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