SCHEMBL1014389

SCHEMBL1014389

Cc1nc(N2CCCC2)ncc1C(=O)NCCN1CCOCC1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
MAPT P10636 3/20 0.51
PDE5A O76074 2/20 0.50
HSD11B1 P28845 1/20 0.49

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
SCHEMBL1015086 0.96 HSD11B1 (0.52) POLBSMN1; SMN2MAPTPDE5AHSD11B1
SCHEMBL1015713 0.96 HSD11B1 (0.53) POLBPDE5AHSD11B1
SCHEMBL1016067 0.91 PDE5A (0.48) PDE5AHSD11B1
SCHEMBL1012298 0.81 MERTK (0.49) POLBSMN1; SMN2
SCHEMBL1014624 0.76 HSD11B1 (0.62) POLBSMN1; SMN2MAPTHSD11B1
SCHEMBL1013801 0.76 HSD11B1 (0.64) POLBSMN1; SMN2MAPTHSD11B1
SCHEMBL1014425 0.76 HSD11B1 (0.61) POLBSMN1; SMN2MAPTHSD11B1
SCHEMBL1015182 0.76 HSD11B1 (0.61) POLBSMN1; SMN2MAPTHSD11B1
SCHEMBL22639956 0.74 KDM5B (0.55) POLB
SCHEMBL1013949 0.73 POLB (0.59) POLBSMN1; SMN2MAPTHSD11B1

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 4 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
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 POLB 2006/4885SMN1; SMN2 2203/4885MAPT 4375/4885

“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.