SCHEMBL8263243

SCHEMBL8263243

CC(C)=CNc1cccc(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.48
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
LMNA P02545 3/20 0.48
HTT P42858 2/20 0.48
ALDH1A1 P00352 2/20 0.48
HTR3E A5X5Y0 1/20 0.46
HTR3B O95264 1/20 0.46
HTR3A P46098 1/20 0.46
HTR3D Q70Z44 1/20 0.46
HTR3C Q8WXA8 1/20 0.46
GAA P10253 5/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
ALOX15 P16050 2/20 0.45
CYP3A4 P08684 1/20 0.45
TSHR P16473 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL11800673 0.77 MEN1 (0.53) MAPTMEN1KMT2ALMNAHTT
SCHEMBL17578612 0.76 MAPT (0.43) MAPTMEN1KMT2ALMNAHTT
SCHEMBL10412163 0.74 ALDH1A1 (0.48) MAPTHTTALDH1A1GAASMN1; SMN2
SCHEMBL4093723 0.74 MEN1 (0.60) MAPTMEN1KMT2ALMNAHTT
SCHEMBL3378202 0.74 MAPT (0.48) MAPTMEN1KMT2ALMNAHTT
SCHEMBL57437 0.74 ALDH1A1 (0.54) MAPTMEN1KMT2ALMNAHTT
SCHEMBL13039531 0.74 ALDH1A1 (0.54) MAPTMEN1KMT2ALMNAHTT
SCHEMBL28166354 0.74 MAPT (0.48) MAPTMEN1KMT2ALMNAHTT
SCHEMBL7239143 0.73 MAPT (0.48) MAPTMEN1KMT2ALMNAHTT
SCHEMBL28825700 0.73 MEN1 (0.55) MAPTMEN1KMT2ALMNAHTT

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
WO-2006032631-A1 INHIBITORS OF THE INTERACTION BETWEEN MDM2 AND P53 JANSSEN PHARMACEUTICA N.V. (BE) 2006-03-30 WO disclosed