SCHEMBL28098282

SCHEMBL28098282

CC(=O)OC1(C(C)=O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@H]1N

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.43
TSHR P16473 1/20 0.43
LMNA P02545 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALOX15 P16050 1/20 0.42
BLM P54132 1/20 0.41
RECQL P46063 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 2/20 0.41
LRAT O95237 2/20 0.41
TRPV1 Q8NER1 1/20 0.41
KMT2A Q03164 1/20 0.39

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
SCHEMBL27635994 0.80 PYGB (0.39)
SCHEMBL29453462 0.74 MEN1 (0.53) TSHRLMNAMEN1KMT2A
SCHEMBL30690851 0.73 MEN1 (0.46) HSD17B10TSHRLMNAKDM4EALOX15
Acetic Acid SCHEMBL7935270 0.72 HSD17B10 (0.51) HSD17B10TSHRLMNAKDM4EALOX15
Acetic Acid SCHEMBL28127820 0.72 HSD17B10 (0.51) HSD17B10TSHRLMNAKDM4EALOX15
Acetic Acid SCHEMBL7937547 0.72 HSD17B10 (0.51) HSD17B10TSHRLMNAKDM4EALOX15
Acetic Acid SCHEMBL15526592 0.72 HSD17B10 (0.51) HSD17B10TSHRLMNAKDM4EALOX15
SCHEMBL25166887 0.71 LMNA (0.43) HSD17B10TSHRLMNAKDM4EALOX15
SCHEMBL8648898 0.71 LMNA (0.43) HSD17B10TSHRLMNAKDM4EALOX15
SCHEMBL1898656 0.71 LMNA (0.43) HSD17B10TSHRLMNAKDM4EALOX15

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-103282513-B Articles and methods for detecting target microorganisms 3M创新有限公司 2016-11-16 CN disclosed