SCHEMBL12252012

SCHEMBL12252012

CCC(C)CN1CCCOC1=O

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 5/20 0.72
PER2 O15055 2/20 0.42
CRY2 Q49AN0 2/20 0.42
GRM2 Q14416 2/20 0.41
GRIN1 Q05586 6/20 0.33
GRIN2B Q13224 6/20 0.33
NAAA Q02083 1/20 0.31

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
SCHEMBL24064132 0.89 PIK3CD (0.56) PIK3CDPER2CRY2GRM2NAAA
SCHEMBL8282897 0.84 PIK3CD (1.00) PIK3CDPER2CRY2GRM2GRIN1
SCHEMBL24909657 0.79 PIK3CD (0.89) PIK3CDPER2CRY2GRM2GRIN1
SCHEMBL6360878 0.77
SCHEMBL8163857 0.75 PIK3CD (0.56) PIK3CDPER2CRY2GRM2GRIN1
SCHEMBL12251950 0.74 PIK3CD (0.59) PIK3CDPER2CRY2GRM2GRIN1
SCHEMBL8240286 0.73 PIK3CD (0.63) PIK3CDPER2CRY2GRM2GRIN1
SCHEMBL13791864 0.73 PIK3CD (0.62) PIK3CDPER2CRY2GRM2GRIN1
SCHEMBL19710935 0.73 PIK3CD (0.58) PIK3CDPER2CRY2GRM2GRIN1
SCHEMBL15354747 0.73 PIK3CD (0.69) PIK3CDPER2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110257100-A1 Inhibitors of Protein Tyrosine Kinase Activity METHYLGENE INC. (CA) 2011-10-20 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-20110257100-A1 Inhibitors of Protein Tyrosine Kinase Activity ERBB2, ABL1, FLT1 PIK3CD 293/4885PER2 2117/4885CRY2 2813/4885

“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.