SCHEMBL6566948

SCHEMBL6566948

COC(=O)C1(NC(=O)OC(C)(C)C)CCC(O)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.35
ALDH1A1 P00352 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CA12 O43570 2/20 0.33
CA14 Q9ULX7 2/20 0.33
HSD11B1 P28845 2/20 0.33
BTK Q06187 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
GAA P10253 1/20 0.32
EPHX1 P07099 1/20 0.31
CA2 P00918 1/20 0.31
CTSK P43235 2/20 0.31
GHSR Q92847 1/20 0.31
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 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
SCHEMBL1219830 0.94 KMT2A (0.39) MEN1MAPK1KMT2AALDH1A1CA12
SCHEMBL16141939 0.91 MAPT (0.40) MEN1MAPK1KMT2AMAPTALDH1A1
SCHEMBL6519301 0.91 MAPT (0.40) MEN1MAPK1KMT2AMAPTALDH1A1
SCHEMBL6519305 0.91 MAPT (0.40) MEN1MAPK1KMT2AMAPTALDH1A1
SCHEMBL5229523 0.88 MEN1 (0.41) MEN1MAPK1KMT2AMAPTALDH1A1
SCHEMBL5934647 0.88 MEN1 (0.41) MEN1MAPK1KMT2AMAPTALDH1A1
SCHEMBL14416213 0.88 MEN1 (0.41) MEN1MAPK1KMT2AMAPTALDH1A1
SCHEMBL4961394 0.87 KMT2A (0.38) MEN1MAPK1KMT2AALDH1A1L3MBTL1
SCHEMBL4434237 0.86 KMT2A (0.38) MEN1MAPK1KMT2AALDH1A1CA12
SCHEMBL25492214 0.86 KMT2A (0.38) MEN1MAPK1KMT2AALDH1A1CA12

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1210324-B1 SUBSTITUTED CYCLOPENTENES, THEIR PREPARATION AND THEIR USE FOR CHIRAL SCAFFOLDS CHIROTECH TECHNOLOGY LTD (GB) 2004-03-31 EP disclosed
EP-0862464-A4 AMINO ACID ANALOGS FOR TUMOR IMAGING UNIV EMORY (US) 2001-07-25 EP disclosed
US-5817776-A TECHNETIUM 99 COMPLEXES, SINGLE PHOTON EMISSION TOMOGRAPHY EMORY UNIVERSITY (US) 1998-10-06 US disclosed
US-5808146-A Amino acid analogs for tumor imaging EMORY UNIVERSITY (US) 1998-09-15 US disclosed
EP-0862464-A1 AMINO ACID ANALOGS FOR TUMOR IMAGING EMORY UNIVERSITY (US) 1998-09-09 EP disclosed
WO-1997017092-A1 AMINO ACID ANALOGS FOR TUMOR IMAGING EMORY UNIVERSITY (US) 1997-05-15 WO disclosed