SCHEMBL3935749

SCHEMBL3935749

CCN1C(=CC=CC=CC=CC2Sc3ccccc3N2CCC[N+](CC)(CC)CC)Sc2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 13/20 0.42
▸ KMT2A Q03164 13/20 0.42
▸ HTT P42858 5/20 0.42
▸ BLM P54132 3/20 0.42
▸ MAPT P10636 10/20 0.42
▸ ALDH1A1 P00352 9/20 0.42
▸ RAB9A P51151 7/20 0.42
▸ NPC1 O15118 6/20 0.42
▸ USP2 O75604 4/20 0.42
▸ SMN1; SMN2 Q16637 4/20 0.42
▸ THRB P10828 3/20 0.42
▸ LMNA P02545 2/20 0.42
▸ RECQL P46063 2/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ ALOX12 P18054 2/20 0.42
▸ GAA P10253 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ XBP1 P17861 1/20 0.42

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
SCHEMBL3932621 0.87 PDF (0.48) MEN1KMT2AHTTBLMMAPT
SCHEMBL28574750 0.86 MEN1 (0.49) MEN1KMT2AHTTBLMMAPT
SCHEMBL17928441 0.86 MEN1 (0.49) MEN1KMT2AHTTBLMMAPT
SCHEMBL15186179 0.86 MEN1 (0.49) MEN1KMT2AHTTBLMMAPT
SCHEMBL3940341 0.83 PDF (0.41) MEN1KMT2AHTTMAPTALDH1A1
SCHEMBL1506902 0.81 MEN1 (0.50) MEN1KMT2AHTTBLMMAPT
SCHEMBL3937804 0.76 PRMT1 (0.36) MEN1KMT2AHTTBLMMAPT
SCHEMBL3943958 0.76 KMT2A (0.35) MEN1KMT2AHTTBLMMAPT
SCHEMBL3936604 0.73 MEN1 (0.37) MEN1KMT2A
SCHEMBL19651915 0.72 PDF (0.48) MEN1KMT2AHTTMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1609459-B1 Use of polycationic compounds for dyeing keratinous fibers OREAL (FR) 2009-04-08 — — EP disclosed
EP-1609459-A1 Use of polycationic compounds for dyeing keratinous fibers L'OREAL (FR) 2005-12-28 — — EP disclosed
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