SCHEMBL17654136

SCHEMBL17654136

Nc1ccc(OC2CCN(c3ccc(N)nc3)CC2)cn1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 8/20 0.41
TRPC6 Q9Y210 2/20 0.40
ACACB O00763 6/20 0.40
KCNH2 Q12809 1/20 0.40
OXTR P30559 1/20 0.39
AVPR1A P37288 1/20 0.39

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
SCHEMBL22663476 0.82 MPO (0.42) TRPC6ACACB
SCHEMBL2822118 0.82 PIK3CA (0.53) TRPC6
SCHEMBL18937320 0.82 HRH3 (0.51) CHRM4
SCHEMBL23634067 0.81 F10 (0.41) TRPC6ACACB
SCHEMBL2824069 0.80 USP2 (0.46) TRPC6
SCHEMBL10255943 0.79 PARP10 (0.46) ACACB
SCHEMBL4018813 0.79 MCHR1 (0.43) ACACB
SCHEMBL31508102 0.79 PARP10 (0.46) ACACB
SCHEMBL31072986 0.78 KCNH2 (0.41) ACACBKCNH2OXTRAVPR1A
SCHEMBL4021756 0.78 MCHR1 (0.45) ACACB

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 10 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-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-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-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
US-20170290815-A1 GLUTAMINASE INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2017-10-12 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 CHRM4 3855/4885TRPC6 4800/4885ACACB 131/4885
US-10245254-B2 Glutaminase inhibitors GLUL, ASNS, GLS CHRM4 3855/4885TRPC6 4800/4885ACACB 131/4885
US-20190167648-A1 GLUTAMINASE INHIBITORS GLUL, ASNS, GLS CHRM4 3887/4885TRPC6 4826/4885ACACB 121/4885
US-11013724-B2 Glutaminase inhibitors GLUL, ASNS, GLS CHRM4 3887/4885TRPC6 4826/4885ACACB 121/4885

“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.