SCHEMBL4293256

SCHEMBL4293256

CN1CCN(Cc2ccc(N)cn2)CC1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.45
TLR7 Q9NYK1 1/20 0.37
MDM2 Q00987 1/20 0.36
SLC2A1 P11166 1/20 0.36
LMNA P02545 2/20 0.36
PIK3CA P42336 1/20 0.35
MTOR P42345 1/20 0.35
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
HRH3 Q9Y5N1 2/20 0.35
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
SLC8A1 P32418 1/20 0.34
HDAC8 Q9BY41 1/20 0.33
PIM1 P11309 2/20 0.33
PAICS P22234 1/20 0.32
TNKS O95271 1/20 0.32
PARP1 P09874 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32

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
SCHEMBL20160951 0.83 PIK3CD (0.45) PIK3CDMDM2SLC2A1PRMT5WDR77
SCHEMBL20160669 0.81 PIK3CD (0.50) PIK3CDMDM2SLC2A1LMNAPRMT5
SCHEMBL3396609 0.80 PIK3CD (0.41) PIK3CDTLR7SLC2A1LMNAPRMT5
SCHEMBL29475484 0.79 LMNA (0.57) LMNAHRH3PAICSKMT2A
SCHEMBL1126227 0.79 LMNA (0.57) LMNAHRH3PAICSKMT2A
SCHEMBL3401709 0.78 LMNA (0.60) PIK3CDTLR7SLC2A1LMNAHRH3
SCHEMBL17403599 0.78 SCN9A (0.41) MDM2SLC2A1PIK3CAKMT2A
SCHEMBL1126270 0.76 GAA (0.49) LMNAHRH3CHRM2CHRM1CHRM3
SCHEMBL1994520 0.75 PIK3CA (0.44) PIK3CDTLR7SLC2A1LMNAPIK3CA
SCHEMBL530048 0.74 HRH3 (0.53) HRH3CHRM2CHRM1CHRM3CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8420657-B2 Pyrrolo[2,3-D]pyrimidines and use thereof as tyrosine kinase inhibitors NOVARTIS AG (CH) 2013-04-16 US disclosed
US-20090203688-A1 HETEROCYCLIC COMPOUNDS NOVARTIS AG 2009-08-13 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-20090203688-A1 HETEROCYCLIC COMPOUNDS ABL1, JAK2, JAK1 PIK3CD 400/4885TLR7 2372/4885MDM2 1473/4885

“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.