SCHEMBL13893906

SCHEMBL13893906

CCCCNc1ccc(NC(C)CCC)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.49
▸ KMT2A Q03164 6/20 0.49
▸ POLB P06746 6/20 0.49
▸ BLM P54132 3/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ NSD2 O96028 2/20 0.49
▸ RXFP1 Q9HBX9 1/20 0.49
▸ APAF1 O14727 1/20 0.49
▸ TOP2B Q02880 1/20 0.48
▸ RAB9A P51151 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ MTOR P42345 1/20 0.46
▸ SIRT2 Q8IXJ6 1/20 0.46
▸ SMN1; SMN2 Q16637 5/20 0.42
▸ MAPK1 P28482 4/20 0.42
▸ L3MBTL1 Q9Y468 4/20 0.42
▸ MAPT P10636 4/20 0.42
▸ HTT P42858 3/20 0.42
▸ NPSR1 Q6W5P4 3/20 0.42
▸ LMNA P02545 3/20 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
SCHEMBL13070793 0.90 SMN1; SMN2 (0.45) MEN1KMT2APOLBBLMALDH1A1
SCHEMBL29364149 0.89 MEN1 (0.59) MEN1KMT2APOLBBLMALDH1A1
SCHEMBL156500 0.89 MEN1 (0.59) MEN1KMT2APOLBBLMALDH1A1
SCHEMBL29368479 0.89 MEN1 (0.59) MEN1KMT2APOLBBLMALDH1A1
SCHEMBL30097103 0.84 MEN1 (0.58) MEN1KMT2APOLBBLMALDH1A1
SCHEMBL439386 0.84 MEN1 (0.58) MEN1KMT2APOLBBLMALDH1A1
SCHEMBL11310247 0.83 MEN1 (0.54) MEN1KMT2APOLBBLMALDH1A1
SCHEMBL1908099 0.83 MEN1 (0.56) MEN1KMT2APOLBBLMALDH1A1
SCHEMBL7855739 0.83 MEN1 (0.56) MEN1KMT2APOLBBLMALDH1A1
SCHEMBL11119733 0.83 MEN1 (0.56) MEN1KMT2APOLBBLMALDH1A1

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-7513947-B2 Imparts color of blue, absorbs visible light with wavelength less than 700 mn and transmit a laser beam with wavelength at 800 nm to 1200 nm in infra-red region EI DU PONT DE NEMOURS AND COMPANY (US) 2009-04-07 — — US disclosed
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