SCHEMBL12494779

SCHEMBL12494779

C#Cc1ccc2c3c(cccc13)C(=O)N(CCCC)C2=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.60
▸ KMT2A Q03164 6/20 0.60
▸ POLB P06746 5/20 0.60
▸ MAPT P10636 3/20 0.60
▸ MAPK1 P28482 2/20 0.60
▸ L3MBTL1 Q9Y468 2/20 0.60
▸ USP2 O75604 2/20 0.60
▸ ATM Q13315 2/20 0.60
▸ NPSR1 Q6W5P4 2/20 0.60
▸ TLR9 Q9NR96 2/20 0.60
▸ RGS12 O14924 1/20 0.60
▸ HTT P42858 1/20 0.60
▸ TDP1 Q9NUW8 1/20 0.60
▸ HDAC1 Q13547 2/20 0.49
▸ HDAC6 Q9UBN7 2/20 0.49
▸ ALDH1A1 P00352 4/20 0.49
▸ LMNA P02545 3/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ PABPC1 P11940 2/20 0.49
▸ NPC1 O15118 2/20 0.49

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
SCHEMBL28580109 0.87 MEN1 (0.60) MEN1KMT2APOLBMAPTMAPK1
SCHEMBL1526815 0.86 CYP1B1 (0.62) MEN1KMT2APOLBMAPTMAPK1
SCHEMBL12495525 0.83 MEN1 (0.56) MEN1KMT2APOLBMAPTMAPK1
SCHEMBL19840190 0.81 MEN1 (0.66) MEN1KMT2APOLBMAPTMAPK1
SCHEMBL17576480 0.81 MEN1 (0.66) MEN1KMT2APOLBMAPTMAPK1
SCHEMBL6887733 0.80 ALDH1A1 (0.74) MEN1KMT2APOLBMAPTMAPK1
SCHEMBL18588698 0.80 MEN1 (0.64) MEN1KMT2APOLBMAPTMAPK1
SCHEMBL3773566 0.80 POLB (0.74) MEN1KMT2APOLBMAPTMAPK1
SCHEMBL17583825 0.80 MEN1 (0.64) MEN1KMT2APOLBMAPTMAPK1
SCHEMBL3891083 0.80 KMT2A (0.74) MEN1KMT2APOLBMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2683714-B1 II (PI)-CONJUGATED FLUOROIONOPHORES AND METHOD FOR DETERMINING AN ALKALI ION UNIV POTSDAM (DE) 2019-01-09 — — EP disclosed
EP-2683714-A1 II (PI)-CONJUGATED FLUOROIONOPHORES AND METHOD FOR DETERMINING AN ALKALI ION Universität Potsdam (DE) 2014-01-15 — — EP disclosed
WO-2012120141-A1 Π (PI)-CONJUGATED FLUOROIONOPHORES AND METHOD FOR DETERMINING AN ALKALI ION UNIVERSITÄT POTSDAM (DE) 2012-09-13 — — WO disclosed
CN-1295219-C Red light emitting naphthyl imide compound and its synthetic method UNIV EAST CHINA SCI & ENG (CN) 2007-01-17 — — CN disclosed
CN-1616429-A Red light emitting naphthyl imide compound and its synthetic method UNIV EAST CHINA SCI & ENG (CN) 2005-05-18 — — CN disclosed
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