SCHEMBL7521073

SCHEMBL7521073

CC(C)(C)OC(=O)NC1CC(C)(C)N(OC(CO)c2ccccc2)C(C)(C)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CCR5 P51681 1/20 0.41
KDM1A O60341 1/20 0.40
MAOB P27338 1/20 0.40
KCNA3 P22001 1/20 0.40
EPHX2 P34913 1/20 0.40
DRD2 P14416 2/20 0.39
HTT P42858 1/20 0.38
CTSK P43235 3/20 0.38
CKS1B P61024 1/20 0.38
SKP1 P63208 1/20 0.38
SKP2 Q13309 1/20 0.38
POLB P06746 1/20 0.37
CTSS P25774 1/20 0.37
MAPK8 P45983 1/20 0.37
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
KDM4D Q6B0I6 1/20 0.35

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
SCHEMBL7517238 0.86 KMT2A (0.40) KMT2AL3MBTL1CCR5KDM1AMAOB
SCHEMBL5342739 0.80 KMT2A (0.41) KMT2AL3MBTL1CCR5KDM1AMAOB
SCHEMBL5065444 0.78 KMT2A (0.52) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL3627121 0.76 GSR (0.38) KMT2ANFKB1
SCHEMBL12273546 0.74 CYP2D6 (0.39) KMT2APOLBNFKB1
SCHEMBL3366770 0.74 TACR1 (0.42) KMT2AHTTPOLBSMN1; SMN2
SCHEMBL15359074 0.73 CYP2D6 (0.39) KMT2APOLBNFKB1
SCHEMBL6305128 0.72 KMT2A (0.44) KMT2APOLBNFKB1
SCHEMBL7554917 0.71 CTSK (0.41) KMT2AL3MBTL1EPHX2DRD2CTSK
SCHEMBL15501122 0.71 GSR (0.40) KMT2A

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
US-20020055124-A1 Soluble support for organic synthesis THE SCRIPPS RESEARCH INSTITUTE 2002-05-09 US disclosed