SCHEMBL8206022

SCHEMBL8206022

CCN(CC)C(=O)CC(C)C.CCN(CC)C(=O)CC(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
ALDH1A1 P00352 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
CA2 P00918 2/20 0.40
HPGD P15428 3/20 0.40
GLA P06280 1/20 0.40
RECQL P46063 1/20 0.40
LTB4R Q15722 1/20 0.39
LTB4R2 Q9NPC1 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP3 P08254 1/20 0.37
MMP8 P22894 1/20 0.37
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36
CA12 O43570 1/20 0.36

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
SCHEMBL77705 1.00 LMNA (0.50) LMNAALDH1A1TDP1CA2HPGD
Hydrochloric Acid SCHEMBL1036864 0.97 LMNA (0.48) LMNAALDH1A1TDP1CA2HPGD
SCHEMBL8211316 0.97 LMNA (0.48) LMNAALDH1A1TDP1CA2HPGD
Hydroxyamine SCHEMBL23849548 0.95 LMNA (0.46) LMNAALDH1A1TDP1CA2HPGD
SCHEMBL7443873 0.93 LMNA (0.44) LMNAALDH1A1TDP1CA2HPGD
Phosphonic Acid SCHEMBL5490946 0.91 LMNA (0.43) LMNAALDH1A1TDP1CA2HPGD
Alanine SCHEMBL18490944 0.87 LMNA (0.40) LMNAALDH1A1TDP1HPGDGLA
Aminomethylamide SCHEMBL8819200 0.87 LMNA (0.40) LMNAALDH1A1TDP1CA2HPGD
Phosphoramidic Acid SCHEMBL3722207 0.87 LMNA (0.45) LMNAALDH1A1TDP1CA2HPGD
Glycine SCHEMBL18490910 0.87 GLRA1 (0.40) LMNAALDH1A1TDP1HPGDGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1639188-A Hepta-, octa-and nonapeptides with anti-angiogenic activity ABBOTT LAB (US) 2005-07-13 CN claimed
CN-1639188-A Hepta-, octa-and nonapeptides with anti-angiogenic activity ABBOTT LAB (US) 2005-07-13 CN disclosed
EP-0971923-A2 SYNTHESIS OF ACYCLIC NUCLEOSIDE DERIVATIVES MEDIVIR AB (SE) 2000-01-19 EP disclosed
US-5869493-A ANTIVIRALS AGAINST HERPES AND RETROVIRUSES MEDIVIR AB (SE) 1999-02-09 US disclosed
WO-1998034917-A2 SYNTHESIS OF ACYCLIC NUCLEOSIDE DERIVATIVES MEDIVIR AB (SE) 1998-08-13 WO disclosed
CN-1132756-A Antiviral ethers of aspartate protease substrate isosteres CIBA GEIGY AG (CH) 1996-10-09 CN disclosed