SCHEMBL17660709

SCHEMBL17660709

CC(C)O[C@H]1CCCN(C(=O)[C@H](C)O)C1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 5/20 0.38
DPP7 Q9UHL4 3/20 0.38
PDE4B Q07343 2/20 0.36
BTK Q06187 3/20 0.34
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NAMPT P43490 1/20 0.32
TBK1 Q9UHD2 2/20 0.32
LMNA P02545 1/20 0.32
JAK2 O60674 1/20 0.32
TAAR1 Q96RJ0 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
SCHEMBL17660711 1.00 DPP4 (0.38) DPP4DPP7PDE4BBTKALDH1A1
SCHEMBL12448279 0.90 MEN1 (0.36) DPP4DPP7PDE4BBTKALDH1A1
SCHEMBL17306170 0.90 MEN1 (0.36) DPP4DPP7PDE4BBTKALDH1A1
SCHEMBL20934784 0.90 MEN1 (0.36) DPP4DPP7PDE4BBTKALDH1A1
SCHEMBL17306140 0.90 MEN1 (0.36) DPP4DPP7PDE4BBTKALDH1A1
SCHEMBL17306184 0.90 MEN1 (0.36) DPP4DPP7PDE4BBTKALDH1A1
SCHEMBL12448278 0.90 MEN1 (0.36) DPP4DPP7PDE4BBTKALDH1A1
SCHEMBL16131147 0.90 MEN1 (0.36) DPP4DPP7PDE4BBTKALDH1A1
SCHEMBL17660723 0.87 DPP4 (0.41) DPP4DPP7PDE4BALDH1A1TBK1
SCHEMBL17665018 0.85 DPP4 (0.46) DPP4DPP7PDE4BBTK

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-10253019-B2 Tank-binding kinase inhibitor compounds GILEAD SCIENCES, INC. (US) 2019-04-09 US disclosed
US-10040781-B2 Tank-binding kinase inhibitor compounds GILEAD SCIENCES, INC. (US) 2018-08-07 US disclosed
US-10040781-B2 Tank-binding kinase inhibitor compounds GILEAD SCIENCES, INC. (US) 2018-08-07 US disclosed
US-20160096827-A1 TANK-BINDING KINASE INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. (US) 2016-04-07 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 (3 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-10253019-B2 Tank-binding kinase inhibitor compounds TBKBP1, TNKS1BP1, TNKS DPP4 3256/4885DPP7 2228/4885PDE4B 3196/4885
US-10040781-B2 Tank-binding kinase inhibitor compounds TBKBP1, TNKS1BP1, TNKS DPP4 3256/4885DPP7 2228/4885PDE4B 3196/4885
US-20160096827-A1 TANK-BINDING KINASE INHIBITOR COMPOUNDS TBKBP1, TNKS1BP1, TNKS DPP4 3256/4885DPP7 2228/4885PDE4B 3196/4885

“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.