SCHEMBL4573449

SCHEMBL4573449

[CH2]N1CCC(N2CC(O)CC2=O)CC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
NPSR1 Q6W5P4 1/20 0.36
APEX1 P27695 1/20 0.35
BLM P54132 1/20 0.35
CYP2C19 P33261 1/20 0.33
ALDH1A1 P00352 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HSD11B1 P28845 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
SCHEMBL4573450 0.82 HSD17B10 (0.40) POLBGAANPSR1APEX1BLM
SCHEMBL16481553 0.79 POLB (0.61) POLBGAANPSR1ALDH1A1L3MBTL1
SCHEMBL16481901 0.79 POLB (0.61) POLBGAANPSR1ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL3075348 0.75 POLB (0.40) POLBGAANPSR1APEX1BLM
SCHEMBL4590248 0.73 APEX1 (0.36) POLBGAAAPEX1BLMCYP2C19
SCHEMBL31441689 0.72 POLB (0.40) POLBGAANPSR1APEX1BLM
SCHEMBL4693552 0.71 CHRM2 (0.55) ALDH1A1
SCHEMBL14116439 0.70 SIGMAR1 (0.43) L3MBTL1
SCHEMBL14116233 0.70 SIGMAR1 (0.43) L3MBTL1
Acetic Acid SCHEMBL4688216 0.70 POLB (0.43) POLBGAANPSR1APEX1BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200454-A1 CARBON-LINKED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S SUNESIS PHARMACEUTICALS, INC. 2008-08-21 US claimed
WO-2008100618-A2 CARBON-LINKED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S SUNESIS PHARMACEUTICALS, INC. (US) 2008-08-21 WO claimed
US-20080200454-A1 CARBON-LINKED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S SUNESIS PHARMACEUTICALS, INC. 2008-08-21 US disclosed
WO-2008100618-A2 CARBON-LINKED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S SUNESIS PHARMACEUTICALS, INC. (US) 2008-08-21 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-20080200454-A1 CARBON-LINKED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S CTSS, CTSK, CTSZ POLB 3153/4885GAA 306/4885NPSR1 633/4885

“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.