SCHEMBL20756194

SCHEMBL20756194

CCC(=O)NC(CC(C)=O)C(=O)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.39
ALDH1A1 P00352 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
PSMB5 P28074 2/20 0.31
MME P08473 1/20 0.31
KMT2A Q03164 2/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
POLB P06746 1/20 0.30
CA2 P00918 1/20 0.30
CA4 P22748 1/20 0.30

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
SCHEMBL19155933 0.85 CYP2C9 (0.39) CYP2C9PSMB5MMEKMT2AMEN1
SCHEMBL18513200 0.85 CYP2C9 (0.39) CYP2C9TDP1PSMB5MMEKMT2A
SCHEMBL16298562 0.82 CYP2C9 (0.43) CYP2C9ALDH1A1TDP1PSMB5MME
SCHEMBL12835663 0.82 ALDH1A1 (0.45) ALDH1A1TDP1
SCHEMBL13857484 0.82 CYP2C9 (0.43) CYP2C9ALDH1A1PSMB5KMT2AMEN1
SCHEMBL20099254 0.80 ALDH1A1 (0.41) ALDH1A1TDP1MME
SCHEMBL19361986 0.78 CYP2C9 (0.41) CYP2C9ALDH1A1PSMB5KMT2AMEN1
SCHEMBL13122874 0.78 CYP2C9 (0.41) CYP2C9ALDH1A1TDP1PSMB5MME
SCHEMBL14131182 0.78 CYP2C9 (0.41) CYP2C9ALDH1A1TDP1PSMB5MME
SCHEMBL25467031 0.78 ALDH1A1 (0.35) ALDH1A1TDP1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210395734-A1 COMPOSITIONS AND METHODS FOR MODULATING APOLIPOPROTEIN C-III EXPRESSION IONIS PHARMACEUTICALS, INC. (US) 2021-12-23 US disclosed
US-20210087566-A1 COMPOSITIONS AND METHODS FOR MODULATING APOLIPOPROTEIN (a) EXPRESSION IONIS PHARMACEUTICALS, INC. 2021-03-25 US disclosed
US-10927372-B2 Compositions and methods for modulating apolipoprotein C-III expression IONIS PHARMACEUTICALS, INC. (US) 2021-02-23 US disclosed
US-20200157548-A1 COMPOSITIONS AND METHODS FOR ENHANCED INTESTINAL ABSORPTION OF CONJUGATED OLIGOMERIC COMPOUNDS IONIS PHARMACEUTICALS, INC. (US) 2020-05-21 US disclosed
US-20190055554-A1 COMPOSITIONS AND METHODS FOR MODULATING HBV EXPRESSION IONIS PHARMACEUTICALS, INC. (US) 2019-02-21 US 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 (5 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-10927372-B2 Compositions and methods for modulating apolipoprotein C-III expression APOB, APOL1, LDLR CYP2C9 3412/4885ALDH1A1 2605/4885TDP1 3618/4885
US-20190055554-A1 COMPOSITIONS AND METHODS FOR MODULATING HBV EXPRESSION HAVCR2, HCCS, HDGF CYP2C9 4151/4885ALDH1A1 3686/4885TDP1 4347/4885
US-20200157548-A1 COMPOSITIONS AND METHODS FOR ENHANCED INTESTINAL ABSORPTION OF CONJUGATED OLIGOMERIC COMPOUNDS SI, FABP2, GNE CYP2C9 1556/4885ALDH1A1 2760/4885TDP1 4589/4885
US-20210087566-A1 COMPOSITIONS AND METHODS FOR MODULATING APOLIPOPROTEIN (a) EXPRESSION APOB, APOL1, LDLR CYP2C9 4017/4885ALDH1A1 1781/4885TDP1 2818/4885
US-20210395734-A1 COMPOSITIONS AND METHODS FOR MODULATING APOLIPOPROTEIN C-III EXPRESSION APOB, APOL1, LDLR CYP2C9 3412/4885ALDH1A1 2605/4885TDP1 3618/4885

“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.