SCHEMBL8939281

SCHEMBL8939281

N[C@@H]1CCCC[C@H]1N.O=C(O)C(O)Cl.[Pt]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MMP2 P08253 2/20 0.33
MMP9 P14780 2/20 0.33
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
LMNA P02545 1/20 0.33
MMP1 P03956 1/20 0.33
MMP3 P08254 1/20 0.33
MMP8 P22894 1/20 0.33
MMP13 P45452 1/20 0.33
EPHX1 P07099 2/20 0.32
GABRR1 P24046 1/20 0.32
GRIN2D O15399 5/20 0.32
GRIN3B O60391 5/20 0.32
GRIN1 Q05586 5/20 0.32
GRIN2A Q12879 5/20 0.32

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
SCHEMBL11367816 0.84 THRB (0.48) THRBMEN1KMT2AMMP2MMP9
Tartaric Acid SCHEMBL30276688 0.81 TSHR (0.50) THRBMEN1KMT2AMMP2MMP9
Cadaverine Tartrate SCHEMBL30899743 0.81 TSHR (0.50) THRBMEN1KMT2AMMP2MMP9
Cadaverine Tartrate SCHEMBL1155812 0.81 TSHR (0.50) THRBMEN1KMT2AMMP2MMP9
Cadaverine Tartrate SCHEMBL918361 0.81 TSHR (0.50) THRBMEN1KMT2AMMP2MMP9
Cadaverine Tartrate SCHEMBL5804440 0.81 TSHR (0.50) THRBMEN1KMT2AMMP2MMP9
Cadaverine Tartrate SCHEMBL17439178 0.81 TSHR (0.50) THRBMEN1KMT2AMMP2MMP9
Cadaverine Tartrate SCHEMBL30899742 0.81 TSHR (0.50) THRBMEN1KMT2AMMP2MMP9
SCHEMBL10895462 0.79 THRB (0.48) THRBMEN1KMT2AMMP2MMP9
Oxalic Acid SCHEMBL5906523 0.78 THRB (0.59) THRBMEN1KMT2AMMP2MMP9

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
US-5585511-A ANTITUMOR AGENTS, SIDE EFFECT REDUCTION SS PHARMACEUTICAL CO., LTD. (JP) 1996-12-17 US disclosed