SCHEMBL15217756

SCHEMBL15217756

CCCCOC1CC[C@@]1(N)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 0.37
GRM8 O00222 1/20 0.37
GRM6 O15303 1/20 0.37
GRM3 Q14832 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
PPP5C P53041 1/20 0.35
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
ARG1 P05089 3/20 0.34
ARG2 P78540 2/20 0.34
GRM5 P41594 1/20 0.33
GRM1 Q13255 1/20 0.33
ALDH1A1 P00352 1/20 0.32
DPP4 P27487 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
Hydrochloric Acid SCHEMBL3006667 0.74 ARG1 (0.38) MEN1KMT2APPP5CLMNAARG1
SCHEMBL8970284 0.72 MEN1 (0.38) MEN1KMT2APPP5CLMNAHTT
SCHEMBL16391357 0.72 LMNA (0.34) GRM2GRM3MEN1KMT2APPP5C
SCHEMBL9537184 0.71 MEN1 (0.40) MEN1KMT2AARG1ARG2ALDH1A1
SCHEMBL12329169 0.71 ARG1 (0.43) GRM2GRM8GRM6GRM3MEN1
SCHEMBL10040088 0.70 GRM4 (0.41) GRM2GRM8GRM6GRM3MEN1
SCHEMBL9914758 0.70 GRM4 (0.41) GRM2GRM8GRM6GRM3MEN1
SCHEMBL13053337 0.69 GRM2 (0.45) GRM2GRM3ALDH1A1DPP4
SCHEMBL7483092 0.68 ALDH1A1 (0.40) GRM2GRM6GRM3LMNAGRM5
SCHEMBL12590723 0.67 SMN1; SMN2 (0.33) LMNAHTT

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-8834841-B2 Imaging agents EMORY UNIVERSITY (US) 2014-09-16 US disclosed
US-20130225828-A1 IMAGING AGENTS EMORY UNIVERSITY (US) 2013-08-29 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-20130225828-A1 IMAGING AGENTS SLC7A1, SSTR1, SSTR3 GRM2 692/4885GRM8 1082/4885GRM6 702/4885

“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.