SCHEMBL30445358

SCHEMBL30445358

CCCCCCN1c2ccccc2Sc2cc(C=CC(=O)C=Cc3ccc4c(c3)Sc3ccccc3N4CCCCCC)ccc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDF Q9HBH1 3/20 0.54
▸ FNTA P49354 4/20 0.48
▸ FNTB P49356 4/20 0.48
▸ HDAC6 Q9UBN7 1/20 0.45
▸ KDM1A O60341 4/20 0.44
▸ HRH1 P35367 2/20 0.44
▸ PIM1 P11309 1/20 0.44
▸ CYP1A2 P05177 3/20 0.43
▸ CYP2D6 P10635 3/20 0.43
▸ TSHR P16473 3/20 0.43
▸ TP53 P04637 2/20 0.43
▸ THPO P40225 2/20 0.43
▸ MTOR P42345 2/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ GMNN O75496 1/20 0.43
▸ MAPT P10636 1/20 0.43

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
SCHEMBL31174402 0.89 PDF (0.49) PDFFNTAFNTBHDAC6KDM1A
SCHEMBL30444589 0.86 PDF (0.44) PDFFNTAFNTBHDAC6
SCHEMBL30444312 0.86 HDAC6 (0.50) FNTAFNTBHDAC6TP53HSD17B10
SCHEMBL31174404 0.85 PDF (0.53) PDFKDM1AHRH1PIM1CYP1A2
SCHEMBL27725977 0.83 PDF (0.47) PDFKDM1AHRH1PIM1CYP1A2
SCHEMBL28910953 0.82 PDF (0.50) PDFKDM1AHRH1PIM1CYP1A2
SCHEMBL28910950 0.82 PDF (0.50) PDFKDM1AHRH1PIM1CYP1A2
SCHEMBL28910976 0.82 PDF (0.50) PDFKDM1AHRH1PIM1CYP1A2
SCHEMBL28910941 0.82 PDF (0.50) PDFKDM1AHRH1PIM1CYP1A2
SCHEMBL27786833 0.81 MARK4 (0.50) PDFKDM1AHRH1PIM1CYP1A2

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
CN-110894191-B Phenothiazinyl conjugated benzylidene ketone photosensitizer as well as preparation method and application thereof 安庆北化大科技园有限公司 2023-06-20 — — CN disclosed
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