SCHEMBL28611540

SCHEMBL28611540

CCOC(OS(=O)(=O)c1ccc(C)cc1)(C(=O)O)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 5/20 0.39
MEN1 O00255 1/20 0.39
STAT3 P40763 1/20 0.38
LMNA P02545 6/20 0.36
RECQL P46063 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HSD17B10 Q99714 1/20 0.36
PPARG P37231 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 2/20 0.36
HCRTR2 O43614 1/20 0.35
HTT P42858 1/20 0.35
MCOLN3 Q8TDD5 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
SCHEMBL2325755 0.77 STAT3 (0.44) KMT2AGAAALDH1A1MEN1STAT3
SCHEMBL10572140 0.77 STAT3 (0.44) KMT2AGAAALDH1A1MEN1STAT3
SCHEMBL10572152 0.77 STAT3 (0.44) KMT2AGAAALDH1A1MEN1STAT3
SCHEMBL1990108 0.76 MEN1 (0.43) KMT2AGAAALDH1A1MEN1STAT3
SCHEMBL27618865 0.74 ALDH1A1 (0.42) KMT2AGAAALDH1A1MEN1STAT3
SCHEMBL10602209 0.74 MEN1 (0.46) KMT2AGAAALDH1A1MEN1STAT3
SCHEMBL20925382 0.74 KMT2A (0.46) KMT2AGAAALDH1A1MEN1LMNA
SCHEMBL10597710 0.73 MEN1 (0.45) KMT2AGAAALDH1A1MEN1STAT3
SCHEMBL10597153 0.72 KMT2A (0.45) KMT2AGAAALDH1A1MEN1LMNA
SCHEMBL8713527 0.72 ALDH1A1 (0.41) KMT2AGAAALDH1A1MEN1STAT3

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
CN-113164775-A Polycyclic compounds and methods for rapid accelerated targeted degradation of fibrosarcoma polypeptides 阿尔维纳斯运营股份有限公司 2021-07-23 CN disclosed