SCHEMBL19823328

SCHEMBL19823328

C=C(CCCN)NCCCCCCCN(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
DNM1 Q05193 3/20 0.39
PAOX Q6QHF9 3/20 0.39
KDM4A O75164 6/20 0.38
HIF1A Q16665 1/20 0.38
TET2 Q6N021 1/20 0.38
DOHH Q9BU89 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
KDM4E B2RXH2 2/20 0.38
CHRM2 P08172 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4C Q9H3R0 5/20 0.33
KDM5A P29375 1/20 0.33
KDM7A Q6ZMT4 1/20 0.33
PHF8 Q9UPP1 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
SCHEMBL24312416 0.82 DNM1 (0.49) DNM1PAOXKDM4AALDH1A1TSHR
SCHEMBL25734114 0.82 DNM1 (0.49) DNM1PAOXKDM4AALDH1A1TSHR
SCHEMBL22072274 0.78 ALDH1A1 (0.44) DNM1PAOXKDM4ACYP2C9CYP2C19
SCHEMBL23791993 0.77 DNM1 (0.65) DNM1PAOXTHRATHRB
SCHEMBL27005541 0.77 SLC6A5 (0.47) DNM1PAOXALDH1A1TSHR
SCHEMBL23607690 0.76 SLC6A5 (0.39) DNM1PAOXALDH1A1TSHR
SCHEMBL20863007 0.75 SLC6A5 (0.54) DNM1PAOXALDH1A1TSHR
SCHEMBL22099464 0.75 SLC6A5 (0.54) DNM1PAOXALDH1A1TSHR
SCHEMBL26019380 0.75 SLC6A5 (0.54) DNM1PAOXALDH1A1TSHR
SCHEMBL19957855 0.74 PAOX (0.48) DNM1PAOXALDH1A1TSHR

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
EP-2837696-B1 HIGH-SENSITIVITY NUCLEIC ACID PREPARATION METHODS FOR THE DETECTION OF NUCLEIC ACID BY NUCLEIC ACID POLYMERASE BIONEER CORP (KR) 2018-01-31 EP disclosed