SCHEMBL27788286

SCHEMBL27788286

CCCCCCN1c2ccccc2Sc2cccc(C=C(C#N)C#N)c21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDF Q9HBH1 3/20 0.47
▸ KDM1A O60341 6/20 0.41
▸ MAPT P10636 5/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ THRB P10828 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ PIM1 P11309 1/20 0.40
▸ CYP2D6 P10635 3/20 0.39
▸ CYP2C19 P33261 3/20 0.39
▸ CYP1A2 P05177 2/20 0.39
▸ HIF1A Q16665 2/20 0.39
▸ SLC22A1 O15245 1/20 0.39
▸ PRNP P04156 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ ADRB2 P07550 1/20 0.39
▸ CHRM2 P08172 1/20 0.39

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
SCHEMBL28362143 0.82 PDF (0.53) PDFKDM1AMAPTSMN1; SMN2PIM1
SCHEMBL27765010 0.80 PDF (0.47) PDFKDM1AMAPTSMN1; SMN2MEN1
SCHEMBL2784918 0.75 PIM1 (0.67) PDFKDM1AMAPTSMN1; SMN2PIM1
SCHEMBL29557345 0.75 PIM1 (0.67) PDFKDM1AMAPTSMN1; SMN2PIM1
SCHEMBL4192605 0.75 PIM1 (0.67) PDFKDM1AMAPTSMN1; SMN2PIM1
SCHEMBL7397164 0.75 PIM1 (0.67) PDFKDM1AMAPTSMN1; SMN2PIM1
SCHEMBL342329 0.75 PIM1 (0.67) PDFKDM1AMAPTSMN1; SMN2PIM1
SCHEMBL28347553 0.75 PIM1 (0.67) PDFKDM1AMAPTSMN1; SMN2PIM1
SCHEMBL31302971 0.75 PIM1 (0.67) PDFKDM1AMAPTSMN1; SMN2PIM1
SCHEMBL6120214 0.75 PIM1 (0.67) PDFKDM1AMAPTSMN1; SMN2PIM1

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
CN-101602747-A 3, the preparation and the application thereof of 7-two replacement-N-hexyl phenothiazine derivatives UNIV HUAZHONG NORMAL (CN) 2009-12-16 — — CN claimed
CN-101602747-B Preparation and application of 3, 7-disubstituted-N-hexyl phenothiazine derivative UNIV HUAZHONG NORMAL 2011-05-11 — — CN disclosed
CN-101602747-A 3, the preparation and the application thereof of 7-two replacement-N-hexyl phenothiazine derivatives UNIV HUAZHONG NORMAL (CN) 2009-12-16 — — CN disclosed
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