SCHEMBL17660723

SCHEMBL17660723

CC(C)OC1CCCN(C(=O)[C@H](C)O)CC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.41
DPP7 Q9UHL4 4/20 0.41
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 1/20 0.38
ROCK2 O75116 1/20 0.35
CYP3A4 P08684 1/20 0.35
PDE4B Q07343 2/20 0.33
TP53 P04637 1/20 0.33
EPHX2 P34913 2/20 0.33
GPR119 Q8TDV5 1/20 0.32
KCNQ3 O43525 1/20 0.32
KCNQ2 O43526 1/20 0.32
HPGD P15428 1/20 0.32
JAK2 O60674 1/20 0.32
TBK1 Q9UHD2 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
SCHEMBL20929383 0.93 ALDH1A1 (0.42) DPP4DPP7MEN1ALDH1A1KMT2A
SCHEMBL10328208 0.93 ALDH1A1 (0.42) DPP4DPP7MEN1ALDH1A1KMT2A
SCHEMBL12448265 0.93 ALDH1A1 (0.42) DPP4DPP7MEN1ALDH1A1KMT2A
SCHEMBL17660709 0.87 DPP4 (0.38) DPP4DPP7ALDH1A1PDE4BJAK2
SCHEMBL17660711 0.87 DPP4 (0.38) DPP4DPP7ALDH1A1PDE4BJAK2
SCHEMBL17665147 0.85 DPP4 (0.49) DPP4DPP7MEN1ALDH1A1KMT2A
SCHEMBL16131147 0.83 MEN1 (0.36) DPP4DPP7MEN1ALDH1A1KMT2A
SCHEMBL20934784 0.83 MEN1 (0.36) DPP4DPP7MEN1ALDH1A1KMT2A
SCHEMBL17306184 0.83 MEN1 (0.36) DPP4DPP7MEN1ALDH1A1KMT2A
SCHEMBL12448278 0.83 MEN1 (0.36) DPP4DPP7MEN1ALDH1A1KMT2A

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 2228/4885MEN1 3091/4885
US-10040781-B2 Tank-binding kinase inhibitor compounds TBKBP1, TNKS1BP1, TNKS DPP4 3256/4885DPP7 2228/4885MEN1 3091/4885
US-20160096827-A1 TANK-BINDING KINASE INHIBITOR COMPOUNDS TBKBP1, TNKS1BP1, TNKS DPP4 3256/4885DPP7 2228/4885MEN1 3091/4885

“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.