SCHEMBL13129124

SCHEMBL13129124

CCC(=O)ON1C(C)(C)CC(OC(=O)OC2CC(C)(C)N(OC(=O)CC)C(C)(C)C2)CC1(C)C

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.42
ESR1 P03372 1/20 0.42
HSD17B10 Q99714 1/20 0.42
HTT P42858 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
SCHEMBL9440233 0.89 KMT2A (0.44) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL9745230 0.86 KMT2A (0.48) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL28621432 0.82 KMT2A (0.48) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL13957191 0.82 TSHR (0.56) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL10430889 0.81 NAAA (0.52) TSHRKMT2AGAAMEN1
SCHEMBL12921994 0.81 TSHR (0.61) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL13130571 0.79 TSHR (0.39) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL10171546 0.79 TSHR (0.46) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL16012942 0.78 KMT2A (0.35) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL13487849 0.77 TSHR (0.42) TSHRKMT2AGAAMEN1ALDH1A1

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-20100249289-A1 RESIN COMPOSITION AND RESIN MOLDED ARTICLE ADEKA CORPORATION (JP) 2010-09-30 US disclosed