SCHEMBL3070180

SCHEMBL3070180

CCOC(=O)CC(NCCCCC#N)C(=O)OCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
CYP1A2 P05177 2/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
HTT P42858 1/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 2/20 0.36
MGAM O43451 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
ALDH1A1 P00352 4/20 0.33
CYP3A4 P08684 2/20 0.33
ALOX15 P16050 2/20 0.33
TSHR P16473 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CHRM1 P11229 1/20 0.33
ADORA1 P30542 1/20 0.33

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
SCHEMBL13791979 0.88 KMT2A (0.47) KMT2APOLBL3MBTL1CYP1A2CYP2C9
SCHEMBL31121509 0.88 KMT2A (0.47) KMT2APOLBL3MBTL1CYP1A2CYP2C9
SCHEMBL27641985 0.83 KMT2A (0.44) KMT2APOLBL3MBTL1CYP1A2CYP2C9
SCHEMBL27641987 0.83 KMT2A (0.44) KMT2APOLBL3MBTL1CYP1A2CYP2C9
SCHEMBL12470925 0.83 KMT2A (0.44) KMT2APOLBL3MBTL1CYP1A2CYP2C9
SCHEMBL16239915 0.83 KMT2A (0.42) KMT2APOLBL3MBTL1CYP1A2CYP2C9
SCHEMBL5474645 0.83 KMT2A (0.47) KMT2APOLBL3MBTL1CYP1A2CYP2C9
SCHEMBL12641015 0.82 CYP1A2 (0.47) KMT2APOLBL3MBTL1CYP1A2CYP2C9
SCHEMBL13420165 0.82 KMT2A (0.43) KMT2APOLBL3MBTL1CYP1A2CYP2C9
SCHEMBL16239707 0.81 KMT2A (0.43) KMT2APOLBL3MBTL1CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100222508-A1 MAGNETIC POLYMER PARTICLES Life Technologies Corporation (US) 2010-09-02 US disclosed
US-20100222508-A1 MAGNETIC POLYMER PARTICLES Life Technologies Corporation (US) 2010-09-02 US disclosed
US-20100222508-A1 MAGNETIC POLYMER PARTICLES Life Technologies Corporation (US) 2010-09-02 US disclosed
EP-2216083-A2 Conjugates of magnetic polymer particles and carboxymethylated aspartic acid Invitrogen Dynal AS (NO) 2010-08-11 EP disclosed
US-20070299249-A1 Polymer Particles DYNAL BIOTECH ASA 2007-12-27 US disclosed
US-20070299249-A1 Polymer Particles DYNAL BIOTECH ASA 2007-12-27 US disclosed
US-20070299249-A1 Polymer Particles DYNAL BIOTECH ASA 2007-12-27 US disclosed
EP-1729880-B1 IMPROVEMENTS IN POLYMER PARTICLES INVITROGEN DYNAL AS (NO) 2007-10-03 EP disclosed
EP-1729880-A1 IMPROVEMENTS IN POLYMER PARTICLES Dynal Biotech ASA (NO) 2006-12-13 EP disclosed
US-20060189797-A1 Magnetic polymer particles INVITROGEN DYNAL AS (NO) 2006-08-24 US disclosed
EP-1638662-A2 CONJUGATES OF MAGNETIC POLYMER PARTICLES AND CARBOXYMETHYLATED ASPARTIC ACID Dynal Biotech ASA (NO) 2006-03-29 EP disclosed
WO-2005089933-A1 IMPROVEMENTS IN POLYMER PARTICLES DYNAL BIOTECH ASA (NO) 2005-09-29 WO disclosed
WO-2005000441-A9 CONJUGATES OF MAGNETIC POLYMER PARTICLES AND CARBOXYMETHYLATED ASPARTIC ACID DYNAL BIOTECH ASA (NO) 2005-07-07 WO disclosed
WO-2005000441-A2 CONJUGATES OF MAGNETIC POLYMER PARTICLES AND CARBOXYMETHYLATED ASPARTIC ACID DYNAL BIOTECH ASA (NO) 2005-01-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070299249-A1 Polymer Particles PHPT1, ATIC, USP39 KMT2A 399/4885POLB 4331/4885L3MBTL1 800/4885
US-20100222508-A1 MAGNETIC POLYMER PARTICLES FOLH1, SLC25A13, GMFG KMT2A 430/4885POLB 2840/4885L3MBTL1 1672/4885
US-20060189797-A1 Magnetic polymer particles FOLH1, SLC25A13, GMFG KMT2A 430/4885POLB 2840/4885L3MBTL1 1672/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.