SCHEMBL7206010

SCHEMBL7206010

CCCCC(N)NCCN

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 4/20 0.39
ALDH1A1 P00352 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
RRM1 P23921 1/20 0.38
GNAI3 P08754 1/20 0.36
GNAO1 P09471 1/20 0.36
GNAI1 P63096 1/20 0.36
OPRM1 P35372 1/20 0.36
DPP8 Q6V1X1 2/20 0.35
DPP9 Q86TI2 2/20 0.35
DNM1 Q05193 4/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.35
EPHX1 P07099 1/20 0.35
SPHK1 Q9NYA1 1/20 0.34

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
SCHEMBL28016909 0.93 OPRM1 (0.44) DPP7ALDH1A1RRM1GNAI3GNAO1
SCHEMBL28317962 0.91 SPHK1 (0.45) DPP7ALDH1A1RRM1GNAI3GNAO1
SCHEMBL10439956 0.86
SCHEMBL28156554 0.84 DPP7 (0.47) DPP7ALDH1A1TDP1RRM1GNAI3
SCHEMBL3817275 0.83 CA12 (0.38) ALDH1A1TDP1MEN1KMT2ATSHR
SCHEMBL11408322 0.82 GNAI3 (0.41) DPP7ALDH1A1TDP1RRM1GNAI3
SCHEMBL28474328 0.82 GNAI3 (0.36) DPP7ALDH1A1RRM1GNAI3GNAO1
SCHEMBL25669684 0.82 DPP7 (0.46) DPP7ALDH1A1RRM1GNAI3GNAO1
SCHEMBL6027114 0.81 GSR (0.38) ALDH1A1TDP1GNAI3GNAO1GNAI1
SCHEMBL6021971 0.81 GNAI3 (0.47) DPP7ALDH1A1RRM1GNAI3GNAO1

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-0912584-B1 NEW BIS-PLATINUM COMPLEXES WITH POLYAMINE LIGANDS AS ANTITUMOR AGENTS HOFFMANN LA ROCHE (CH) 2002-12-18 EP disclosed
US-6022892-A Bis-platinum complexes with polyamine ligands as antitumor agents HOFFMAN-LA ROCHE INC. (US) 2000-02-08 US disclosed
EP-0912584-A2 NEW BIS-PLATINUM COMPLEXES WITH POLYAMINE LIGANDS AS ANTITUMOR AGENTS F. HOFFMANN-LA ROCHE AG (CH) 1999-05-06 EP disclosed
WO-1998003519-A9 NEW BIS-PLATINUM COMPLEXES WITH POLYAMINE LIGANDS AS ANTITUMOR AGENTS 1998-07-16 WO disclosed
WO-1998003519-A2 NEW BIS-PLATINUM COMPLEXES WITH POLYAMINE LIGANDS AS ANTITUMOR AGENTS F. HOFFMANN-LA ROCHE AG (CH) 1998-01-29 WO disclosed