SCHEMBL1015366

SCHEMBL1015366

C[C@@H]1CN(c2ncc(C(=O)O)c(C3CCCO3)n2)C[C@H](C)O1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.62
ALOX15 P16050 1/20 0.39
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
HDAC6 Q9UBN7 1/20 0.35
CAMK1D Q8IU85 1/20 0.35
MTOR P42345 2/20 0.34
PIK3R1 P27986 1/20 0.34
PIK3CA P42336 1/20 0.34
AOC3 Q16853 2/20 0.34
RBP4 P02753 1/20 0.34
KCNH2 Q12809 1/20 0.34
KDM4E B2RXH2 4/20 0.33
MAPT P10636 1/20 0.33
GAK O14976 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
POLB P06746 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
SCHEMBL1015365 1.00 HSD11B1 (0.62) HSD11B1ALOX15ALDH1A1MEN1GAA
SCHEMBL1015671 1.00 HSD11B1 (0.62) HSD11B1ALOX15ALDH1A1MEN1GAA
SCHEMBL1015452 0.88 HSD11B1 (0.62) HSD11B1ALOX15ALDH1A1MEN1GAA
SCHEMBL1015147 0.88 HSD11B1 (0.62) HSD11B1ALOX15ALDH1A1MEN1GAA
SCHEMBL1015145 0.88 HSD11B1 (0.62) HSD11B1ALOX15ALDH1A1MEN1GAA
SCHEMBL1018557 0.83 HSD11B1 (0.54) HSD11B1ALOX15ALDH1A1MEN1GAA
SCHEMBL1015050 0.78 HSD11B1 (1.00) HSD11B1
SCHEMBL1015051 0.78 HSD11B1 (1.00) HSD11B1
SCHEMBL1014801 0.78 HSD11B1 (1.00) HSD11B1
SCHEMBL1014630 0.78 HSD11B1 (1.00) HSD11B1

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
EP-2271629-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 AstraZeneca AB (SE) 2011-01-12 EP disclosed
WO-2009130496-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 ASTRAZENECA AB (SE) 2009-10-29 WO disclosed
US-20090264401-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 ASTRAZENECA AB (SE) 2009-10-22 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 (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-20090264401-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 CYP2S1, HSD11B1, HSD3B1 HSD11B1 2/4885ALOX15 242/4885ALDH1A1 53/4885

“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.