SCHEMBL10936393

SCHEMBL10936393

CC(=O)CC(=O)Nc1nc2c(C)cc(Cl)cc2s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.58
▸ RAB9A P51151 3/20 0.58
▸ MAPT P10636 7/20 0.49
▸ ALDH1A1 P00352 4/20 0.47
▸ KDM4E B2RXH2 3/20 0.47
▸ GAA P10253 1/20 0.47
▸ DYRK1A Q13627 1/20 0.45
▸ FSCN1 Q16658 1/20 0.45
▸ LMNA P02545 2/20 0.44
▸ RORC P51449 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ NFKB1 P19838 1/20 0.42
▸ NFKB2 Q00653 1/20 0.42
▸ RELA Q04206 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ ATM Q13315 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 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
SCHEMBL10988958 0.89 LMNA (0.54) NPC1RAB9AMAPTALDH1A1GAA
SCHEMBL10933809 0.83 MAPT (0.50) NPC1RAB9AMAPTALDH1A1KDM4E
SCHEMBL10935002 0.79 SMN1; SMN2 (0.42) NPC1RAB9AMAPTALDH1A1DYRK1A
SCHEMBL24648720 0.79 NPC1 (0.61) NPC1RAB9AMAPTALDH1A1KDM4E
SCHEMBL10933165 0.78 ALDH1A1 (0.69) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL5928965 0.77 DYRK1A (0.75) NPC1RAB9AMAPTALDH1A1KDM4E
SCHEMBL10939352 0.77 MAPT (0.45) NPC1RAB9AMAPTALDH1A1KDM4E
SCHEMBL16126079 0.75 NPC1 (0.52) NPC1RAB9AMAPTALDH1A1KDM4E
SCHEMBL10936135 0.75 RAB9A (0.50) NPC1RAB9AMAPTALDH1A1DYRK1A
SCHEMBL10939456 0.75 GAA (0.63) NPC1RAB9AMAPTALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0051560-B1 MONOAZOPIGMENTS CONTAINING HETEROCYCLIC NUCLEI, THEIR PREPARATION AND USE CIBA-GEIGY AG (CH) 1985-01-16 — — EP disclosed
US-4400319-A Monoazo pigments containing heterocycles, and high-molecular organic materials dyed therewith CIBA-GEIGY CORPORATION (US) 1983-08-23 — — US disclosed
EP-0051560-A1 Monoazopigments containing heterocyclic nuclei, their preparation and use CIBA-GEIGY AG (CH) 1982-05-12 — — EP disclosed
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