SCHEMBL4907547

SCHEMBL4907547

CN(Cc1ccc(C(N)=O)cc1)C[C@H]1CCCO1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.54
MAPT P10636 2/20 0.50
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
OXTR P30559 3/20 0.47
AVPR1A P37288 3/20 0.47
NPC1 O15118 1/20 0.45
HPGD P15428 1/20 0.45
TP53 P04637 3/20 0.45

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
SCHEMBL4905603 1.00 GAA (0.54) GAAMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL5316912 1.00 GAA (0.54) GAAMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL63670 0.85 KMT2A (0.64) GAAMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL4429295 0.83 MAPT (0.54) GAAMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL3094416 0.82 GAA (0.45) GAAMAPTKMT2AMEN1L3MBTL1
SCHEMBL3094410 0.82 GAA (0.45) GAAMAPTKMT2AMEN1L3MBTL1
SCHEMBL3190543 0.82 GAA (0.45) GAAMAPTKMT2AMEN1L3MBTL1
SCHEMBL82476 0.81 KMT2A (0.51) GAAMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL16373718 0.80 GAA (0.59) GAAMAPTKMT2AMEN1L3MBTL1
SCHEMBL1190859 0.79 OXTR (0.51) GAAMAPTKMT2AMEN1ALDH1A1

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
US-20080108611-A1 SUBSTITUTED THIENOPYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-05-08 US claimed
US-20080108611-A1 SUBSTITUTED THIENOPYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-05-08 US disclosed
WO-2006118749-A1 THIA-TETRAAZAACENAPHTHYLENE KINASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-11-09 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-20080108611-A1 SUBSTITUTED THIENOPYRIMIDINE KINASE INHIBITORS MAP4K2, MAP3K6, MAP3K2 GAA 2160/4885MAPT 2641/4885KMT2A 1506/4885

“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.