SCHEMBL4878181

SCHEMBL4878181

CCOC(=O)c1cnc(N2CC(C(=O)OC(C)(C)C)C2)c(Cl)c1N

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.42
KMT2A Q03164 5/20 0.39
ALDH1A1 P00352 5/20 0.39
MEN1 O00255 3/20 0.39
GAA P10253 2/20 0.39
ALOX15 P16050 1/20 0.39
KDM4E B2RXH2 3/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
LMNA P02545 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
P2RY12 Q9H244 1/20 0.37
USP2 O75604 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
TP53 P04637 1/20 0.37
CSNK1D P48730 2/20 0.36
HPGD P15428 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
SCHEMBL27716753 0.86 HSD11B1 (0.45) HSD11B1KMT2AALDH1A1MEN1GAA
Hydrochloric Acid SCHEMBL4878686 0.85 HSD11B1 (0.44) HSD11B1KMT2AALDH1A1MEN1GAA
SCHEMBL4104827 0.78 NEK2 (0.45) KMT2AALDH1A1MEN1LMNAP2RY12
SCHEMBL4880593 0.74 P2RY12 (0.61) P2RY12
SCHEMBL4115398 0.71 P2RY12 (0.61) KDM4EP2RY12
SCHEMBL4104185 0.71 NPC1 (0.50) KMT2AALDH1A1MEN1KDM4ENPC1
SCHEMBL30064908 0.71 NPC1 (0.50) KMT2AALDH1A1MEN1KDM4ENPC1
SCHEMBL3326567 0.71 P2RY12 (0.50) KMT2AALDH1A1MEN1KDM4ELMNA
SCHEMBL3326970 0.70 L3MBTL1 (0.52) KMT2AALDH1A1MEN1GAAKDM4E
SCHEMBL3328353 0.69 P2RY12 (0.50) KMT2AALDH1A1MEN1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080312208-A1 Pyridine Analogues ASTRAZENECA AB (SE) 2008-12-18 US disclosed
EP-1904474-A1 NEW PYRIDINE ANALOGUES AstraZeneca AB (SE) 2008-04-02 EP disclosed
WO-2007008140-A1 NEW PYRIDINE ANALOGUES ASTRAZENECA AB (SE) 2007-01-18 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 (1 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-20080312208-A1 Pyridine Analogues P2RY12, P2RY11, P2RY1 HSD11B1 2336/4885KMT2A 3584/4885ALDH1A1 1274/4885

“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.