SCHEMBL30356388

SCHEMBL30356388

CCN1/C(=C/C=C/C=C/C=C/c2sc3ccccc3[n+]2CC)Sc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 1.00
▸ MEN1 O00255 6/20 1.00
▸ HTT P42858 5/20 1.00
▸ BLM P54132 4/20 1.00
▸ NPC1 O15118 6/20 0.98
▸ RAB9A P51151 6/20 0.98
▸ MAPT P10636 4/20 0.98
▸ THRB P10828 3/20 0.98
▸ PKM P14618 3/20 0.98
▸ NPSR1 Q6W5P4 3/20 0.98
▸ ALDH1A1 P00352 3/20 0.98
▸ POLB P06746 2/20 0.98
▸ RECQL P46063 2/20 0.98
▸ SMN1; SMN2 Q16637 2/20 0.98
▸ TDP1 Q9NUW8 2/20 0.98
▸ USP2 O75604 2/20 0.98
▸ ALOX12 P18054 2/20 0.98
▸ CTNNB1 P35222 2/20 0.98
▸ KDM4E B2RXH2 1/20 0.98
▸ LMNA P02545 1/20 0.98

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
Dithiazanine SCHEMBL10035960 1.00 KMT2A (1.00) KMT2AMEN1HTTBLMNPC1
Dithiazanine SCHEMBL17278433 1.00 KMT2A (1.00) KMT2AMEN1HTTBLMNPC1
Dithiazanine SCHEMBL1567134 1.00 KMT2A (1.00) KMT2AMEN1HTTBLMNPC1
SCHEMBL10110715 1.00 KMT2A (1.00) KMT2AMEN1HTTBLMNPC1
SCHEMBL13898198 1.00 KMT2A (1.00) KMT2AMEN1HTTBLMNPC1
SCHEMBL1598509 1.00 KMT2A (1.00) KMT2AMEN1HTTBLMNPC1
SCHEMBL12868063 1.00 KMT2A (1.00) KMT2AMEN1HTTBLMNPC1
Iodide SCHEMBL335663 0.99 MEN1 (1.00) KMT2AMEN1HTTBLMNPC1
Dithiazanine SCHEMBL22877 0.99 MEN1 (1.00) KMT2AMEN1HTTBLMNPC1
Bromide SCHEMBL11693039 0.99 KMT2A (0.98) KMT2AMEN1HTTBLMNPC1

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
EP-4161680-A1 THE USE OF PHOTOTHERMAL AGENTS IN THE AIR FILTERS Sabanci Üniversitesi Nanoteknoloji Arastirma Ve Uygulama Merkezi Sunum (TR) 2023-04-12 — — EP disclosed
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