SCHEMBL25745949

SCHEMBL25745949

NC(=O)Nc1ccc(C(=O)NCCC2CCCC2)nc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 3/20 0.53
▸ MAPK14 Q16539 3/20 0.53
▸ LCK P06239 1/20 0.53
▸ SRC P12931 1/20 0.53
▸ MAOB P27338 2/20 0.47
▸ MAOA P21397 1/20 0.47
▸ HDAC6 Q9UBN7 1/20 0.46
▸ PRMT3 O60678 3/20 0.45
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ PDE7A Q13946 1/20 0.43
▸ NAMPT P43490 3/20 0.42
▸ FPR2 P25090 1/20 0.41

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
SCHEMBL25745964 0.76 MAOB (0.45) MAOBHDAC6NAMPT
SCHEMBL25745961 0.75 LMNA (0.48) MAOBHDAC6NAMPT
SCHEMBL25745959 0.73 NAMPT (0.68) HDAC6NPC1RAB9ANAMPT
SCHEMBL936546 0.73 SCD (0.47) MAOBMAOANPC1RAB9AL3MBTL1
SCHEMBL25745885 0.73 NAMPT (0.48) MAOBHDAC6NPC1RAB9ANAMPT
SCHEMBL2943870 0.71 KIT (0.79) KITMAPK14LCKSRC
SCHEMBL25745892 0.71 NAMPT (0.41) MAOBHDAC6NAMPT
SCHEMBL937257 0.70 SCD (0.52) MAOBMAOA
SCHEMBL2952365 0.69 KIT (1.00) KITMAPK14LCKSRC
SCHEMBL31004385 0.69 KIT (1.00) KITMAPK14LCKSRC

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-3781554-B1 2,6-DIAMINO-3,4-DIHYDROPYRIMIDIN-4-ONE DERIVATIVES AND USE THEREOF IN THERAPY THOMAS HELLEDAYS STIFTELSE FOER MEDICINSK FORSKNING (SE) 2023-06-28 — — EP disclosed
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