SCHEMBL9052767

SCHEMBL9052767

CC(N)=C(C)c1nc2ccccc2s1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.57
RECQL P46063 1/20 0.57
ALDH1A1 P00352 6/20 0.54
L3MBTL1 Q9Y468 3/20 0.50
LMNA P02545 2/20 0.50
ALOX15 P16050 2/20 0.50
TSHR P16473 1/20 0.50
CASP1 P29466 1/20 0.50
RAB9A P51151 6/20 0.47
NPC1 O15118 5/20 0.47
MAPT P10636 5/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
HPGD P15428 4/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
PKM P14618 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
MAPK1 P28482 1/20 0.47

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
SCHEMBL21865146 0.85 THRB (0.65) THRBRECQLALDH1A1L3MBTL1LMNA
SCHEMBL369480 0.78 ALDH1A1 (0.62) THRBRECQLALDH1A1L3MBTL1LMNA
SCHEMBL1827781 0.78 ALDH1A1 (0.53) THRBRECQLALDH1A1L3MBTL1LMNA
SCHEMBL569032 0.78 ALDH1A1 (0.67) THRBRECQLALDH1A1L3MBTL1LMNA
SCHEMBL12545749 0.78 RECQL (0.65) THRBRECQLALDH1A1L3MBTL1LMNA
Hydrochloric Acid SCHEMBL3492104 0.76 ALDH1A1 (0.60) THRBRECQLALDH1A1L3MBTL1LMNA
Hydrochloric Acid SCHEMBL5009760 0.76 ALDH1A1 (0.60) THRBRECQLALDH1A1L3MBTL1LMNA
SCHEMBL14505846 0.76 RECQL (0.58) THRBRECQLALDH1A1L3MBTL1LMNA
SCHEMBL12016637 0.76 RECQL (0.58) THRBRECQLALDH1A1L3MBTL1LMNA
SCHEMBL14845420 0.75 THRB (0.53) THRBRECQLALDH1A1L3MBTL1LMNA

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-0690857-A1 CYCLIC AMIDE COMPOUNDS, PROCESS FOR THEIR PRODUCTION AND HERBICIDAL COMPOSITIONS CONTAINING THEM ISHIHARA SANGYO KAISHA, LTD. (JP) 1996-01-10 EP disclosed
WO-1994013665-A1 CYCLIC AMIDE COMPOUNDS, PROCESS FOR THEIR PRODUCTION AND HERBICIDAL COMPOSITIONS CONTAINING THEM ISHIHARA SANGYO KAISHA LTD. (JP) 1994-06-23 WO disclosed