SCHEMBL4963475

SCHEMBL4963475

CC(C)(C)OC(=O)NC1(C(=O)I)CC1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPK1 P28482 1/20 0.38
GHSR Q92847 1/20 0.35
CTSL P07711 1/20 0.35
APLNR P35414 1/20 0.34
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GAA P10253 4/20 0.33
BTK Q06187 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
DGAT1 O75907 1/20 0.32
CTSK P43235 1/20 0.32
EPHX1 P07099 1/20 0.31

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
SCHEMBL15125130 0.93 MEN1 (0.36) MEN1KMT2AMAPK1GHSRCTSL
SCHEMBL15125132 0.93 MEN1 (0.36) MEN1KMT2AMAPK1GHSRCTSL
SCHEMBL16359134 0.92 TSHR (0.34) MEN1KMT2AMAPK1GHSRCTSL
SCHEMBL15125133 0.91 GAA (0.36) MEN1KMT2AMAPK1GHSRCTSL
SCHEMBL3926984 0.85 MEN1 (0.36) MEN1KMT2AMAPK1GHSRCTSL
SCHEMBL144836 0.82 MEN1 (0.39) MEN1KMT2AMAPK1GHSRCTSL
SCHEMBL142219 0.82 MEN1 (0.39) MEN1KMT2AMAPK1GHSRCTSL
SCHEMBL2392486 0.81 KMT2A (0.38) MEN1KMT2AMAPK1GHSRCTSL
SCHEMBL20624889 0.81 KMT2A (0.41) MEN1KMT2AMAPK1GHSRCTSL
SCHEMBL1820679 0.81 MAPT (0.39) MEN1KMT2AMAPK1GHSRCTSL

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-1893581-A1 SUBSTITUTED ARYLPYRAZOLES FOR USE AGAINST PARASITITES Pfizer Limited (GB) 2008-03-05 EP disclosed
WO-2006134468-A1 SUBSTITUTED ARYLPYRAZOLES FOR USE AGAINST PARASITITES PFIZER LIMITED (GB) 2006-12-21 WO disclosed