SCHEMBL2117085

SCHEMBL2117085

Cc1c(F)ccc2cc(C(NC(=O)O)C(C)(C)C)c(Cl)nc12

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 15/20 0.36
EGLN1 Q9GZT9 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
EPRS1 P07814 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
HRH4 Q9H3N8 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
SCHEMBL716685 0.84 L3MBTL1 (0.34) PDE2ASMN1; SMN2EPRS1HRH4
SCHEMBL2115559 0.81 MAPT (0.43) SMN1; SMN2
SCHEMBL616122 0.72 LMNA (0.33) PDE2ASMN1; SMN2
SCHEMBL715781 0.71
SCHEMBL715780 0.71
SCHEMBL14482160 0.69 MEN1 (0.35) PDE2AEPRS1
SCHEMBL2117089 0.68 ALDH1A1 (0.42) SMN1; SMN2EPRS1
SCHEMBL17530830 0.67
SCHEMBL17530832 0.67
SCHEMBL863617 0.67 ALDH1A1 (0.35) SMN1; SMN2EPRS1

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-20120095005-A1 Fused Bicyclic Pyrazole Derivatives As Kinase Inhibitors UCB PHARMA S.A. (BE) 2012-04-19 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-20120095005-A1 Fused Bicyclic Pyrazole Derivatives As Kinase Inhibitors PI4KA, PDPK1, PIK3CA PDE2A 1300/4885EGLN1 3864/4885SMN1; SMN2 2618/4885

“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.