SCHEMBL6504356

SCHEMBL6504356

CN1CCN(C(=O)c2cc(Nc3ccccc3)cc(-c3ccnc(NC(=O)C4CCOC4)c3)c2)CC1

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIP5K1C O60331 19/20 0.75
PIK3CA P42336 15/20 0.75
PIP5K1B O14986 4/20 0.68
PIP5K1A Q99755 4/20 0.68
PIK3CD O00329 3/20 0.68
PDGFRB P09619 3/20 0.68
PIK3CB P42338 3/20 0.68
PI4KA P42356 3/20 0.68
PIK3CG P48736 3/20 0.68
PDK1 Q15118 3/20 0.68
PI4KB Q9UBF8 3/20 0.68
MAPK8 P45983 2/20 0.67
MAPK10 P53779 2/20 0.67
MAPK14 Q16539 2/20 0.67

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
SCHEMBL6502242 0.89 PIP5K1C (0.75) PIP5K1CPIK3CAPIP5K1BPIP5K1APIK3CD
SCHEMBL6502234 0.87 PIP5K1C (0.83) PIP5K1CPIK3CAPIP5K1BPIP5K1APIK3CD
SCHEMBL6505419 0.85 PIP5K1C (0.81) PIP5K1CPIK3CAPIP5K1BPIP5K1APIK3CD
SCHEMBL6501419 0.85 PIP5K1C (1.00) PIP5K1CPIK3CAPIP5K1BPIP5K1APIK3CD
SCHEMBL6503191 0.85 PIP5K1C (0.80) PIP5K1CPIK3CAPIP5K1BPIP5K1APIK3CD
SCHEMBL6501916 0.84 PIP5K1C (0.71) PIP5K1CPIK3CAPIP5K1BPIP5K1APIK3CD
SCHEMBL6530941 0.84 PIP5K1C (0.68) PIP5K1CPIK3CAPIP5K1BPIP5K1APIK3CD
SCHEMBL6504987 0.83 PIP5K1C (1.00) PIP5K1CPIK3CAPIP5K1BPIP5K1APIK3CD
SCHEMBL6500541 0.82 PIP5K1C (0.82) PIP5K1CPIK3CAPIP5K1BPIP5K1APIK3CD
SCHEMBL6504296 0.81 PIP5K1C (0.79) PIP5K1CPIK3CAPIP5K1BPIP5K1APIK3CD

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
WO-2005003123-A1 NOVEL PYRIDINE DERIVATIVES AS JNK SPECIFIC INHIBITORS ASTRAZENECA AB (SE) 2005-01-13 WO claimed
US-20050070558-A1 6-Phenyldihydropyrrolopyrimidinedione derivatives ALMIRALL PRODESFARMA S.A. (ES) 2005-03-31 US disclosed
WO-2005003123-A1 NOVEL PYRIDINE DERIVATIVES AS JNK SPECIFIC INHIBITORS ASTRAZENECA AB (SE) 2005-01-13 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-20050070558-A1 6-Phenyldihydropyrrolopyrimidinedione derivatives ADORA1, ADORA2A, P2RY10 PIP5K1C 1894/4885PIK3CA 979/4885PIP5K1B 1605/4885

“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.