SCHEMBL1013190

SCHEMBL1013190

CC(C)c1ncc(C(=O)O)c(C2CCCC2)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
KMT2A Q03164 2/20 0.37
GLA P06280 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HIF1A Q16665 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HSD11B1 P28845 3/20 0.37
KDM6B O15054 1/20 0.36
KDM4A O75164 1/20 0.36
KDM4D Q6B0I6 1/20 0.36
KDM3B Q7LBC6 1/20 0.36
HIF1AN Q9NWT6 1/20 0.36
KDM2A Q9Y2K7 1/20 0.36
KCNH2 Q12809 1/20 0.36
TMEM97 Q5BJF2 1/20 0.36
ACMSD Q8TDX5 2/20 0.35
KDM5A P29375 1/20 0.35
KDM5B Q9UGL1 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
SCHEMBL8140882 0.94 KDM4E (0.39) KDM4EKMT2ASMN1; SMN2HSD11B1KCNH2
SCHEMBL1014150 0.85 JAK2 (0.38) KDM4EHSD11B1JAK2JAK1JAK3
SCHEMBL1015020 0.80 HSD11B1 (0.52) KDM4EKMT2AGLAHTTSMN1; SMN2
SCHEMBL28059199 0.79 HSD11B1 (0.51) KDM4EKMT2AGLAHTTSMN1; SMN2
SCHEMBL1014340 0.77 KDM4E (0.40) KDM4EKMT2AGLAHTTSMN1; SMN2
SCHEMBL1587409 0.77 KMT2A (0.44) KDM4EKMT2AGLAHTTSMN1; SMN2
SCHEMBL1014941 0.75 KMT2A (0.43) KDM4EKMT2AGLAHTTSMN1; SMN2
SCHEMBL1014147 0.73 KMT2A (0.44) KDM4EKMT2AGLAHTTSMN1; SMN2
SCHEMBL6991254 0.73 KDM4E (0.38) KDM4EKMT2AGLAHTTSMN1; SMN2
SCHEMBL1015670 0.73 HSD11B1 (0.50) KDM4EKMT2ASMN1; SMN2TDP1HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102066335-A Substituted pyrimidin-5-carboxamides 281 ASTRAZENECA AB 2011-05-18 CN disclosed
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
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
US-20090264401-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 ASTRAZENECA AB (SE) 2009-10-22 US 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 KDM4E 1727/4885KMT2A 1860/4885GLA 3534/4885

“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.