SCHEMBL1300478

SCHEMBL1300478

CCOC(=O)C(=CN(C)C)C(=O)c1nc(Cl)ccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
CYP11B1 P15538 2/20 0.39
CYP11B2 P19099 2/20 0.39
HPGD P15428 3/20 0.39
ALDH1A1 P00352 3/20 0.38
KMT2A Q03164 5/20 0.38
MEN1 O00255 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP2C9 P11712 2/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 2/20 0.37
GAA P10253 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 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
SCHEMBL1300477 1.00 L3MBTL1 (0.40) L3MBTL1CYP11B1CYP11B2HPGDALDH1A1
SCHEMBL2086904 0.84 MEN1 (0.38) CYP11B1CYP11B2HPGDALDH1A1KMT2A
SCHEMBL2086908 0.84 MEN1 (0.38) CYP11B1CYP11B2HPGDALDH1A1KMT2A
SCHEMBL21858958 0.81 NPSR1 (0.42) L3MBTL1HPGDALDH1A1KMT2AMEN1
SCHEMBL14698346 0.81 CYP11B1 (0.47) L3MBTL1CYP11B1CYP11B2HPGDALDH1A1
SCHEMBL21858959 0.81 NPSR1 (0.42) L3MBTL1HPGDALDH1A1KMT2AMEN1
SCHEMBL15868733 0.81 CYP11B1 (0.47) L3MBTL1CYP11B1CYP11B2HPGDALDH1A1
SCHEMBL22400089 0.81 HPGD (0.37) CYP11B1CYP11B2HPGDALDH1A1KMT2A
SCHEMBL22118240 0.79 NPSR1 (0.39) CYP11B1CYP11B2HPGDALDH1A1KMT2A
SCHEMBL12646759 0.79 NPSR1 (0.39) CYP11B1CYP11B2HPGDALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269741-A1 NOVEL COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2011-11-03 US disclosed
US-20110166123-A1 NOVEL COMPOSITIONS AND METHODS OF USE AARDEA BIOSCIENCES, INC. (US) 2011-07-07 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 (2 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-20110166123-A1 NOVEL COMPOSITIONS AND METHODS OF USE TYMP, SAMHD1, PNP L3MBTL1 1224/4885CYP11B1 2508/4885CYP11B2 3189/4885
US-20110269741-A1 NOVEL COMPOSITIONS AND METHODS OF USE TYMP, SAMHD1, PNP L3MBTL1 1224/4885CYP11B1 2508/4885CYP11B2 3189/4885

“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.