SCHEMBL1014376

SCHEMBL1014376

CSc1ncc(C(=O)O)c([C@@H]2CCCO2)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
PDE4B Q07343 5/20 0.39
KDM4E B2RXH2 1/20 0.37
HSD11B1 P28845 2/20 0.36
THRB P10828 1/20 0.36
RXFP1 Q9HBX9 3/20 0.35
KDM6B O15054 1/20 0.34
KDM4A O75164 1/20 0.34
KDM4D Q6B0I6 1/20 0.34
HIF1AN Q9NWT6 1/20 0.34
KDM2A Q9Y2K7 1/20 0.34
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAPT P10636 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
PDE3B Q13370 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
SCHEMBL1013178 1.00 MEN1 (0.40) MEN1KMT2APDE4BKDM4EHSD11B1
SCHEMBL1013177 1.00 MEN1 (0.40) MEN1KMT2APDE4BKDM4EHSD11B1
SCHEMBL1013989 0.86 PDE4B (0.42) MEN1KMT2APDE4BKDM4EHSD11B1
SCHEMBL1013988 0.86 PDE4B (0.42) MEN1KMT2APDE4BKDM4EHSD11B1
SCHEMBL1014372 0.86 PDE4B (0.42) MEN1KMT2APDE4BKDM4EHSD11B1
SCHEMBL4298013 0.83 HSD11B1 (0.38) MEN1KMT2AHSD11B1APEX1
SCHEMBL1014147 0.80 KMT2A (0.44) MEN1KMT2APDE4BKDM4ETHRB
SCHEMBL1587409 0.80 KMT2A (0.44) MEN1KMT2APDE4BKDM4EHSD11B1
SCHEMBL1014948 0.79 MEN1 (0.46) MEN1KMT2APDE4BKDM4ETHRB
SCHEMBL1014941 0.79 KMT2A (0.43) MEN1KMT2APDE4BKDM4EHSD11B1

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
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
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 MEN1 1994/4885KMT2A 1860/4885PDE4B 474/4885

“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.