SCHEMBL4336160

SCHEMBL4336160

N=C(NN)NC1CCCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
GAA P10253 1/20 0.52
EPHX1 P07099 5/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP3A4 P08684 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
KDM4E B2RXH2 1/20 0.42
EPHX2 P34913 1/20 0.42
SIGMAR1 Q99720 4/20 0.39
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
MMP2 P08253 2/20 0.37
CA9 Q16790 2/20 0.37
MMP1 P03956 1/20 0.37
MMP8 P22894 1/20 0.35

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
SCHEMBL10590700 0.98 LMNA (0.56) LMNAGAAEPHX1SMN1; SMN2ALDH1A1
Iodide SCHEMBL11299060 0.95 LMNA (0.54) LMNAGAAEPHX1SMN1; SMN2ALDH1A1
SCHEMBL14289080 0.90
SCHEMBL3915783 0.84 EPHX1 (0.50) LMNAGAAEPHX1SMN1; SMN2ALDH1A1
SCHEMBL2740861 0.81 EPHX1 (0.55) LMNAGAAEPHX1SMN1; SMN2ALDH1A1
SCHEMBL4269726 0.81 SMYD3 (0.36) LMNAGAA
SCHEMBL4269720 0.81 SMYD3 (0.36) LMNAGAA
SCHEMBL3070836 0.77 EPHX1 (0.50) LMNAGAAEPHX1SMN1; SMN2ALDH1A1
SCHEMBL4094504 0.76 SIGMAR1 (0.41) LMNAGAAEPHX1SMN1; SMN2ALDH1A1
SCHEMBL4103966 0.75 SIGMAR1 (0.43) LMNAGAAEPHX1SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1583522-A1 USE OF CYCLIN D1 INHIBITORS Forskarpatent i Syd AB (SE) 2005-10-12 EP claimed
WO-2004062654-A1 USE OF CYCLIN D1 INHIBITORS FORSKARPATENT I SYD AB (SE) 2004-07-29 WO claimed
EP-1357881-A4 INHIBITORS OF SPERMIDINE SYNTHASE FOR THE TREATMENT OF OSTEOARTHRITIS AND CARTILAGE REHABILITATION QUARK PHARMACEUTICALS INC (US) 2009-02-18 EP disclosed
US-6696454-B2 ADMINISTERING AN INHIBITOR OF SPERMIDINE BIOSYNTHESIS; PREFERRED ARE DCHA (DICYCLOHEXYLAMINE), ADODATO, AND TRANS-4-METHYLCYCLOHEXYLAMINE (4MCHA) QUARK BIOTECH, INC. 2004-02-24 US disclosed
EP-1357881-A2 INHIBITORS OF SPERMIDINE SYNTHASE FOR THE TREATMENT OF OSTEOARTHRITIS AND CARTILAGE REHABILITATION Quark Biotech, Inc. (US) 2003-11-05 EP disclosed
US-20020160978-A1 Inhibitors of spermidine synthase for the treatment of osteoarthritis and cartilage rehabilitation QUARK PHARMACEUTICALS, INC. 2002-10-31 US disclosed
WO-2002058623-A2 INHIBITORS OF SPERMIDINE SYNTHASE FOR THE TREATMENT OF OSTEOARTHRITIS AND CARTILAGE REHABILITATION QUARK BIOTECH, INC. (US) 2002-08-01 WO disclosed