SCHEMBL300008

SCHEMBL300008

CCN(CC)C(=O)C(C(C)C)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.39
LMNA P02545 1/20 0.39
DPP4 P27487 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP3 P08254 1/20 0.37
MMP8 P22894 1/20 0.37
HTT P42858 3/20 0.36
HTR1A P08908 1/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GAA P10253 1/20 0.33
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA9 Q16790 2/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HSP90AA1 P07900 2/20 0.32
HSP90AB1 P08238 2/20 0.32

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
SCHEMBL18098236 0.81 LMNA (0.40) SMN1; SMN2LMNADPP4ALDH1A1MMP1
SCHEMBL3200366 0.78 LMNA (0.42) SMN1; SMN2LMNADPP4ALDH1A1MMP1
SCHEMBL23467149 0.77 DPP4 (0.37) SMN1; SMN2LMNADPP4ALDH1A1MMP1
SCHEMBL16160320 0.77 DPP4 (0.37) SMN1; SMN2LMNADPP4ALDH1A1MMP1
SCHEMBL17652005 0.76 LMNA (0.40) SMN1; SMN2LMNADPP4ALDH1A1MMP1
SCHEMBL3898588 0.76 LMNA (0.40) SMN1; SMN2LMNADPP4ALDH1A1MMP1
SCHEMBL1964784 0.76 LMNA (0.40) SMN1; SMN2LMNADPP4ALDH1A1MMP1
SCHEMBL1615608 0.76 LMNA (0.40) SMN1; SMN2LMNADPP4ALDH1A1MMP1
SCHEMBL1619585 0.75 DPP4 (0.47) SMN1; SMN2LMNADPP4ALDH1A1MMP1
SCHEMBL1619583 0.75 DPP4 (0.47) SMN1; SMN2LMNADPP4ALDH1A1MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115956704-A Composition for improving compliance of buccal preparation 东莞市吉纯生物技术有限公司 2023-04-14 CN claimed
CN-115956704-A Composition for improving compliance of buccal preparation 东莞市吉纯生物技术有限公司 2023-04-14 CN disclosed
EP-2427170-A2 ORGANIC COMPOUNDS HAVING COOLING PROPERTIES Givaudan SA (CH) 2012-03-14 EP disclosed
WO-2010128026-A2 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2010-11-11 WO disclosed