SCHEMBL3291882

SCHEMBL3291882

CN(CCSS(=O)(=O)[O-])c1ccc(C=Cc2n(C)c3ccccc3[n+]2C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.46
▸ MEN1 O00255 6/20 0.46
▸ LMNA P02545 5/20 0.36
▸ RAB9A P51151 8/20 0.36
▸ POLB P06746 5/20 0.36
▸ KDM4E B2RXH2 4/20 0.36
▸ HTT P42858 5/20 0.35
▸ BCHE P06276 3/20 0.33
▸ ACHE P22303 3/20 0.33
▸ INSR P06213 2/20 0.33
▸ NPC1 O15118 5/20 0.32
▸ PKM P14618 5/20 0.32
▸ MAPT P10636 5/20 0.32
▸ MAPK1 P28482 5/20 0.32
▸ NPSR1 Q6W5P4 5/20 0.32
▸ NSD2 O96028 3/20 0.32
▸ L3MBTL1 Q9Y468 3/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ THRB P10828 2/20 0.32
▸ RECQL P46063 2/20 0.32

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
SCHEMBL3291880 0.90 MEN1 (0.41) KMT2AMEN1LMNARAB9APOLB
SCHEMBL3294198 0.87 MEN1 (0.43) KMT2AMEN1LMNARAB9APOLB
SCHEMBL3294204 0.87 MEN1 (0.43) KMT2AMEN1LMNARAB9APOLB
SCHEMBL3834682 0.87 RAB9A (0.40) KMT2AMEN1LMNARAB9APOLB
SCHEMBL3834687 0.87 RAB9A (0.40) KMT2AMEN1LMNARAB9APOLB
Sulfuric Acid Dimethyl Ester SCHEMBL3837602 0.85 MEN1 (0.41) KMT2AMEN1LMNARAB9APOLB
SCHEMBL3291935 0.85 KMT2A (0.46) KMT2AMEN1LMNARAB9APOLB
SCHEMBL3291938 0.85 KMT2A (0.46) KMT2AMEN1LMNARAB9APOLB
SCHEMBL3838342 0.84 MEN1 (0.39) KMT2AMEN1LMNARAB9APOLB
SCHEMBL3838343 0.84 MEN1 (0.39) KMT2AMEN1LMNARAB9APOLB

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
US-7727287-B2 Hemicyanin styryl thiol/disulfide dye, composition comprising hemicyanin styryl thoil/disulfide dye, and method for lightening keratin materials using hemicyanin styryl thiol/disulfide dye L'OREAL S.A. (FR) 2010-06-01 — — US disclosed
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