SCHEMBL570181

SCHEMBL570181

CCn1nccc1C(=O)ON

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ MAPT P10636 2/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.48
▸ HPGD P15428 1/20 0.48
▸ HTT P42858 2/20 0.46
▸ MAPK1 P28482 1/20 0.37
▸ FLT1 P17948 1/20 0.36
▸ KDR P35968 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ PDE2A O00408 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ ABL1 P00519 1/20 0.34
▸ SRC P12931 1/20 0.34

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
SCHEMBL24937400 0.84 L3MBTL1 (0.56) RAB9ANPC1L3MBTL1MEN1KMT2A
SCHEMBL1431721 0.83 RAB9A (0.50) RAB9ANPC1L3MBTL1MEN1KMT2A
SCHEMBL2660301 0.80 MEN1 (0.51) RAB9ANPC1L3MBTL1MEN1KMT2A
SCHEMBL262196 0.78 MEN1 (0.53) RAB9ANPC1L3MBTL1MEN1KMT2A
SCHEMBL336115 0.78 KMT2A (0.53) RAB9ANPC1L3MBTL1MEN1KMT2A
SCHEMBL21617355 0.77 KMT2A (0.60) RAB9ANPC1L3MBTL1MEN1KMT2A
SCHEMBL23361461 0.77 KMT2A (0.49) RAB9ANPC1L3MBTL1MEN1KMT2A
SCHEMBL16963334 0.77 KMT2A (0.55) RAB9ANPC1L3MBTL1MEN1KMT2A
Hydrochloric Acid SCHEMBL23354141 0.76 MEN1 (0.48) RAB9ANPC1L3MBTL1MEN1KMT2A
SCHEMBL29158106 0.75 KMT2A (0.50) RAB9ANPC1L3MBTL1MEN1KMT2A

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-2601192-A1 FUSED HETEROCYCLIC COMPOUNDS Takeda Pharmaceutical Company Limited (JP) 2013-06-12 — — EP disclosed
WO-2012018909-A1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-02-09 — — WO disclosed
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