SCHEMBL10933809

SCHEMBL10933809

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.50
▸ ACP1 P24666 2/20 0.49
▸ NPC1 O15118 6/20 0.49
▸ ALDH1A1 P00352 4/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ GAA P10253 2/20 0.48
▸ RORC P51449 1/20 0.45
▸ LMNA P02545 3/20 0.45
▸ RAB9A P51151 4/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ TP53 P04637 2/20 0.44
▸ CSNK1D P48730 1/20 0.44
▸ DYRK1A Q13627 1/20 0.44
▸ NFKB1 P19838 1/20 0.43
▸ NFKB2 Q00653 1/20 0.43
▸ RELA Q04206 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ MITF O75030 1/20 0.43

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 0.88 LMNA (0.54) MAPTNPC1ALDH1A1GAALMNA
SCHEMBL10939456 0.84 GAA (0.63) MAPTACP1NPC1ALDH1A1KDM4E
SCHEMBL10936393 0.83 NPC1 (0.58) MAPTNPC1ALDH1A1KDM4EGAA
SCHEMBL10935002 0.78 SMN1; SMN2 (0.42) MAPTNPC1ALDH1A1LMNARAB9A
SCHEMBL10936133 0.77 DYRK1A (0.74) MAPTACP1NPC1ALDH1A1KDM4E
SCHEMBL10935986 0.74 DYRK1A (0.74) MAPTACP1NPC1ALDH1A1KDM4E
SCHEMBL10933165 0.74 ALDH1A1 (0.69) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL10936135 0.73 RAB9A (0.50) MAPTACP1NPC1ALDH1A1RAB9A
SCHEMBL10935898 0.73 DYRK1A (0.59) MAPTNPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL5928965 0.73 DYRK1A (0.75) MAPTNPC1ALDH1A1KDM4ERAB9A

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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