SCHEMBL21783090

SCHEMBL21783090

CN(c1ncccn1)[C@H]1CCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 8/20 0.58
GPR119 Q8TDV5 5/20 0.55
VNN1 O95497 1/20 0.54
JAK2 O60674 1/20 0.51
JAK1 P23458 1/20 0.51
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47

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
SCHEMBL22087745 1.00 USP30 (0.58) USP30GPR119VNN1JAK2JAK1
SCHEMBL21790196 0.88 VNN1 (0.51) USP30GPR119VNN1JAK2JAK1
SCHEMBL10223191 0.88 USP30 (0.53) USP30GPR119VNN1JAK2JAK1
SCHEMBL28834232 0.82 USP30 (0.52) USP30GPR119VNN1JAK2JAK1
SCHEMBL28834231 0.82 USP30 (0.52) USP30GPR119VNN1JAK2JAK1
SCHEMBL13326823 0.82 GPR119 (0.53) USP30GPR119JAK2JAK1
SCHEMBL972277 0.82 GPR119 (0.53) USP30GPR119JAK2JAK1
SCHEMBL1307415 0.81 GPR119 (0.60) USP30GPR119MEN1KMT2A
SCHEMBL29862618 0.81 USP30 (0.48) USP30GPR119VNN1JAK2JAK1
SCHEMBL28834263 0.81 USP30 (0.48) USP30GPR119VNN1JAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295112-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2023-09-21 US disclosed
US-20230295112-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2023-09-21 US disclosed
US-20220048889-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-02-17 US disclosed
US-20220048885-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2022-02-17 US disclosed
US-11078182-B2 Heteroaromatic compounds as Vanin inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2021-08-03 US disclosed
US-20210059992-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2021-03-04 US disclosed
US-10864201-B2 Heteroaromatic compounds as Vanin inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2020-12-15 US disclosed
WO-2020114943-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2020-06-11 WO disclosed
WO-2020114947-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2020-06-11 WO disclosed
US-20200172508-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2020-06-04 US disclosed
WO-2020043658-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2020-03-05 WO disclosed
US-20200069663-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2020-03-05 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 (8 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-20200069663-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS VHL, FANCI, PAH USP30 3167/4885GPR119 2006/4885VNN1 23/4885
US-20220048885-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS VHL, FANCI, PAH USP30 3167/4885GPR119 2006/4885VNN1 23/4885
US-20200172508-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS VHL, FANCI, PAH USP30 3167/4885GPR119 2006/4885VNN1 23/4885
US-11078182-B2 Heteroaromatic compounds as Vanin inhibitors VHL, FANCI, PAH USP30 3167/4885GPR119 2006/4885VNN1 23/4885
US-20210059992-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS VHL, FANCI, PAH USP30 3167/4885GPR119 2006/4885VNN1 23/4885
US-10864201-B2 Heteroaromatic compounds as Vanin inhibitors VHL, FANCI, PAH USP30 3167/4885GPR119 2006/4885VNN1 23/4885
US-20230295112-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS VHL, FANCI, PAH USP30 3167/4885GPR119 2006/4885VNN1 23/4885
US-20220048889-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS VHL, FANCI, PAH USP30 3167/4885GPR119 2006/4885VNN1 23/4885

“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.