SCHEMBL17654075

SCHEMBL17654075

Nc1nnc(OC2CN(C(=O)O)C2)s1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GLS O94925 9/20 0.44
SMN1; SMN2 Q16637 1/20 0.35
ATM Q13315 1/20 0.33
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.32
F2 P00734 1/20 0.32
SCD O00767 1/20 0.32
CSNK2A2 P19784 1/20 0.31
CSNK2B P67870 1/20 0.31
CSNK2A1 P68400 1/20 0.31
POLB P06746 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
SCHEMBL17654143 0.88 GLS (0.45) GLSSMN1; SMN2ATM
SCHEMBL17654135 0.88 GLS (0.45) GLSSMN1; SMN2ATM
SCHEMBL17654137 0.88 GLS (0.45) GLSSMN1; SMN2ATM
SCHEMBL17654163 0.86 GLS (0.41) GLSSMN1; SMN2ATM
SCHEMBL17654154 0.84 GLS (0.46) GLSSMN1; SMN2ATM
SCHEMBL17664629 0.80 GPR119 (0.43) GLS
SCHEMBL17654116 0.75 GLS (0.41) GLSSMN1; SMN2ATMHTTHSD17B10
SCHEMBL17654171 0.75 GLS (0.41) GLSSMN1; SMN2ATMHTTHSD17B10
SCHEMBL31083338 0.74 GLS (0.46) GLSSMN1; SMN2
SCHEMBL17654083 0.73 GLS (0.54) GLSSMN1; SMN2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11013724-B2 Glutaminase inhibitors University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2021-05-25 US disclosed
US-20190167648-A1 GLUTAMINASE INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2019-06-06 US disclosed
US-10245254-B2 Glutaminase inhibitors University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2019-04-02 US disclosed
US-20170290815-A1 GLUTAMINASE INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2017-10-12 US disclosed
WO-2016054388-A1 GLUTAMINASE INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2016-04-07 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 (4 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-20170290815-A1 GLUTAMINASE INHIBITORS GLUL, ASNS, GLS GLS 3/4885SMN1; SMN2 3248/4885ATM 3289/4885
US-10245254-B2 Glutaminase inhibitors GLUL, ASNS, GLS GLS 3/4885SMN1; SMN2 3248/4885ATM 3289/4885
US-20190167648-A1 GLUTAMINASE INHIBITORS GLUL, ASNS, GLS GLS 3/4885SMN1; SMN2 3228/4885ATM 3238/4885
US-11013724-B2 Glutaminase inhibitors GLUL, ASNS, GLS GLS 3/4885SMN1; SMN2 3228/4885ATM 3238/4885

“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.