SCHEMBL28072269

SCHEMBL28072269

CCC(CN)NCC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.36
ACE P12821 1/20 0.36
CPA1 P15085 1/20 0.36
ACE2 Q9BYF1 1/20 0.36
DNM1 Q05193 1/20 0.35
LMNA P02545 4/20 0.33
TDP1 Q9NUW8 2/20 0.33
GABRR1 P24046 2/20 0.33
ADRA1A P35348 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
PTGS2 P35354 1/20 0.33
CNR1 P21554 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP8 P22894 1/20 0.33
CA9 Q16790 1/20 0.33

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
SCHEMBL7044031 0.86 MME (0.41) MMEACECPA1ACE2LMNA
SCHEMBL16267385 0.84 MME (0.39) MMEACECPA1ACE2LMNA
SCHEMBL1766228 0.80 LMNA (0.44) LMNATDP1GABRR1ADRA1AALDH1A1
SCHEMBL1643592 0.80 LMNA (0.56) MMEACECPA1ACE2LMNA
SCHEMBL3723836 0.78 MME (0.36) MMEACECPA1ACE2LMNA
SCHEMBL18558762 0.78 TDP1 (0.39) MMEACECPA1ACE2LMNA
SCHEMBL10337935 0.77 MME (0.35) MMEACECPA1ACE2LMNA
SCHEMBL2723590 0.77 GABRR1 (0.32) LMNAGABRR1GLRA1SLC6A9OR51E2
SCHEMBL10348782 0.77 GABRR1 (0.37) LMNAGABRR1ADRA1ACACNA2D1CACNB3
SCHEMBL11664768 0.77

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-106102703-A Comprise internal olefin sulphonates and the composition, foam of a kind of polymer suspending agent 莱雅公司 2016-11-09 CN disclosed
CN-105722497-A Foaming composition comprising at least one glycinate surfactant 欧莱雅 2016-06-29 CN disclosed