SCHEMBL7209833

SCHEMBL7209833

NCCCCCCCNC(=O)CCCCCN

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 2/20 0.67
PAOX Q6QHF9 4/20 0.59
KDM4A O75164 1/20 0.53
HIF1A Q16665 1/20 0.53
TET2 Q6N021 1/20 0.53
DOHH Q9BU89 1/20 0.53
CASP2 P42575 1/20 0.52
FAAH O00519 3/20 0.50
ALDH1A1 P00352 2/20 0.50
LMNA P02545 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 1/20 0.50
PLG P00747 1/20 0.50
THRB P10828 1/20 0.50
ALOX15 P16050 1/20 0.50
SLC6A2 P23975 1/20 0.50
RECQL P46063 1/20 0.50
SLC6A3 Q01959 1/20 0.50
KMT2A Q03164 1/20 0.50
KDM4E B2RXH2 1/20 0.49

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
SCHEMBL13887195 1.00 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL17373920 1.00 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL7208668 1.00 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL7215984 1.00 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL12863577 1.00 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL7203302 1.00 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL7215946 1.00 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL7208464 1.00 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL8995394 1.00 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
Hydrochloric Acid SCHEMBL17373841 0.98 SLC6A5 (0.68) SLC6A5PAOXKDM4AHIF1ATET2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0920434-A3 BIS-PLATINUM COMPLEXES WITH POLYMETHYLENE DERIVATIVES AS LIGANDS HAVING ANTITUMOR ACTIVITY F.HOFFMANN-LA ROCHE AG (CH) 2003-06-04 EP disclosed
EP-0920434-B1 BIS-PLATINUM COMPLEXES WITH POLYMETHYLENE DERIVATIVES AS LIGANDS HAVING ANTITUMOR ACTIVITY HOFFMANN LA ROCHE (CH) 2002-10-16 EP disclosed
US-6060616-A ANTITUMORS AGENTS; LEUKEMIA, OVARIAN CARCINOMA HOFFMANN-LA ROCHE INC. (US) 2000-05-09 US disclosed
EP-0920434-A2 BIS-PLATINUM COMPLEXES WITH POLYMETHYLENE DERIVATIVES AS LIGANDS HAVING ANTITUMOR ACTIVITY F.HOFFMANN-LA ROCHE AG (CH) 1999-06-09 EP disclosed
WO-1998003518-A2 NEW BIS-PLATINUM COMPLEXES WITH POLYMETHYLENE DERIVATIVES AS LIGANDS HAVING ANTITUMOR ACTIVITY F. HOFFMANN-LA ROCHE AG (CH) 1998-01-29 WO disclosed