SCHEMBL31373252

SCHEMBL31373252

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP3 P08254 1/20 0.39
MMP8 P22894 1/20 0.39
ALDH1A1 P00352 6/20 0.34
ALDH2 P05091 2/20 0.34
HPGD P15428 2/20 0.33
TSHR P16473 2/20 0.33
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA9 Q16790 2/20 0.33
FFAR3 O14843 1/20 0.33
MAPT P10636 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GLA P06280 1/20 0.33
MAPK1 P28482 1/20 0.32
NPC1 O15118 1/20 0.32
L3MBTL1 Q9Y468 1/20 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
Hydrochloric Acid SCHEMBL11688808 0.97 LMNA (0.47) LMNAMMP1MMP2MMP3MMP8
SCHEMBL6298780 0.82
SCHEMBL210439 0.78 LMNA (0.52) LMNAMMP1MMP2MMP3MMP8
Hydrochloric Acid SCHEMBL11684866 0.77 CA12 (0.48) LMNAMMP1MMP2MMP3MMP8
SCHEMBL11688804 0.76 LMNA (0.39) LMNAMMP1MMP2MMP3MMP8
SCHEMBL42300 0.76
SCHEMBL5406160 0.76
Fluoride SCHEMBL29204710 0.76 LMNA (0.50) LMNAMMP1MMP2MMP3MMP8
SCHEMBL3827023 0.74
Hydrochloric Acid SCHEMBL11685465 0.74 LMNA (0.45) LMNAMMP1MMP2MMP3MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119438562-A Cell lysate and protein pretreatment method based on digital microfluidic system 广东奥素液芯微纳科技有限公司 2025-02-14 CN disclosed
WO-2025025339-A1 CELL LYSIS BUFFER BASED ON DIGITAL MICROFLUIDIC SYSTEM, QUANTITATIVE PIPETTING DEVICE AND PRE-TREATMENT METHOD FOR PROTEIN 广东奥素液芯微纳科技有限公司 2025-02-06 WO disclosed