SCHEMBL11203448

SCHEMBL11203448

NNC(=O)[C@@H]1CCCC[C@@H]1N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MMP2 P08253 2/20 0.37
MMP9 P14780 2/20 0.37
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA9 Q16790 2/20 0.37
MMP1 P03956 1/20 0.37
MMP3 P08254 1/20 0.37
MMP8 P22894 1/20 0.37
MMP13 P45452 1/20 0.37
ALDH1A1 P00352 3/20 0.36
LMNA P02545 1/20 0.36
CTSC P53634 5/20 0.36
KCNH2 Q12809 2/20 0.36
EPHX1 P07099 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 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
SCHEMBL11352807 1.00 THRB (0.39) THRBMEN1KMT2AMMP2MMP9
SCHEMBL11203449 1.00 THRB (0.39) THRBMEN1KMT2AMMP2MMP9
SCHEMBL11203445 1.00 THRB (0.39) THRBMEN1KMT2AMMP2MMP9
SCHEMBL11208018 1.00 THRB (0.39) THRBMEN1KMT2AMMP2MMP9
SCHEMBL3623530 0.85 ALDH1A1 (0.45) ALDH1A1LMNAEPHX1CYP1A2CYP3A4
SCHEMBL29250547 0.85 ALDH1A1 (0.45) ALDH1A1LMNAEPHX1CYP1A2CYP3A4
SCHEMBL2061686 0.80 GRM4 (0.45) THRBMEN1KMT2AMMP2MMP9
SCHEMBL2061687 0.80 GRM4 (0.45) THRBMEN1KMT2AMMP2MMP9
SCHEMBL2061690 0.80 GRM4 (0.45) THRBMEN1KMT2AMMP2MMP9
SCHEMBL5897133 0.77 ALDH1A1 (0.36) CA1CA2ALDH1A1LMNAEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0008936-B1 PLATINUM COMPLEXES, PROCESSES FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS MEDICAMENTS Kidani, Yoshinori (JP) 1983-02-16 EP disclosed
US-4255347-A ANTITUMOR AGENTS Kidani, Yoshinori (JP) 1981-03-10 US disclosed
EP-0008936-A1 Platinum complexes, processes for their preparation, pharmaceutical compositions containing them and their use as medicaments Kidani, Yoshinori (JP) 1980-03-19 EP disclosed