SCHEMBL7632047

SCHEMBL7632047

C[C](C)OOC(=O)c1ccc(C)cc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
RAB9A P51151 4/20 0.43
NPC1 O15118 3/20 0.43
TNF P01375 1/20 0.43
PKM P14618 1/20 0.43
CDK5 Q00535 1/20 0.43
KLF5 Q13887 1/20 0.43
CDK5R1 Q15078 1/20 0.43
NOD1 Q9Y239 1/20 0.43
NFE2L2 Q16236 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 1/20 0.41
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
TAS1R2 Q8TE23 1/20 0.40
MAPT P10636 3/20 0.40
HSD11B1 P28845 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL124710 0.92 KMT2A (0.49) KMT2AMEN1RAB9ANPC1TNF
SCHEMBL19256975 0.83 TAS1R3 (0.48) KMT2AMEN1RAB9ANPC1TNF
SCHEMBL7634150 0.83 SMN1; SMN2 (0.44) KMT2AMEN1RAB9ANPC1TNF
SCHEMBL7635274 0.81 KMT2A (0.44) KMT2AMEN1RAB9ANPC1TNF
SCHEMBL7625603 0.80 TAS1R3 (0.47) KMT2AMEN1RAB9ANPC1TNF
SCHEMBL6113261 0.80 KMT2A (0.49) KMT2AMEN1RAB9ANPC1TNF
SCHEMBL29462647 0.80 KMT2A (0.49) KMT2AMEN1RAB9ANPC1TNF
SCHEMBL7631201 0.80 KMT2A (0.44) KMT2AMEN1RAB9ANPC1TNF
SCHEMBL8527590 0.79 KMT2A (0.48) KMT2AMEN1RAB9ANPC1TNF
SCHEMBL158111 0.79 TDP1 (0.57) KMT2AMEN1SMN1; SMN2HTTTAS1R3

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
EP-1233014-A1 ASYMMETRIC ORGANIC PEROXIDE, CROSSLINKING AGENT COMPRISING THE SAME, AND METHOD OF CROSSLINKING WITH THE SAME NOF CORPORATION (JP) 2002-08-21 EP disclosed