SCHEMBL15906201

SCHEMBL15906201

CC(C)(O)C(=O)N[C@H]1CC[C@H](C)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.52
PDK1 Q15118 1/20 0.46
PDK2 Q15119 1/20 0.46
PDK3 Q15120 1/20 0.46
PDK4 Q16654 1/20 0.46
PKM P14618 1/20 0.42
RAB9A P51151 5/20 0.41
NPC1 O15118 4/20 0.41
ALDH1A1 P00352 3/20 0.40
ADRA2A P08913 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MMP2 P08253 1/20 0.39
MMP8 P22894 1/20 0.39
TAS1R3 Q7RTX0 2/20 0.38
TAS1R1 Q7RTX1 2/20 0.38
TAS1R2 Q8TE23 2/20 0.38
MAPK1 P28482 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
GFER P55789 1/20 0.38

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
SCHEMBL13246733 0.85 EPHX1 (0.53) EPHX1PDK1PDK2PDK3PDK4
SCHEMBL26140573 0.85 EPHX1 (0.53) EPHX1PDK1PDK2PDK3PDK4
Hydrochloric Acid SCHEMBL29904533 0.83 EPHX1 (0.52) EPHX1PDK1PDK2PDK3PDK4
SCHEMBL6420804 0.82 EPHX1 (0.50) EPHX1PDK1PDK2PDK3PDK4
SCHEMBL14654944 0.82 EPHX1 (0.50) EPHX1PDK1PDK2PDK3PDK4
SCHEMBL25676344 0.82 EPHX1 (0.50) EPHX1PDK1PDK2PDK3PDK4
SCHEMBL14654898 0.82 EPHX1 (0.50) EPHX1PDK1PDK2PDK3PDK4
SCHEMBL25676313 0.82 EPHX1 (0.50) EPHX1PDK1PDK2PDK3PDK4
SCHEMBL13446730 0.80 PDK1 (0.43) EPHX1PDK1PDK2PDK3PDK4
SCHEMBL12436660 0.80 PDK1 (0.43) EPHX1PDK1PDK2PDK3PDK4

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-11702414-B2 Thiadiazole IRAK4 inhibitors GILEAD SCIENCES, INC. (US) 2023-07-18 US disclosed
US-20220402910-A1 THIADIAZOLE IRAK4 INHIBITORS GILEAD SCIENCES, INC. 2022-12-22 US disclosed
US-11046686-B2 Thiadiazole IRAK4 compounds GILEAD SCIENCES, INC. (US) 2021-06-29 US disclosed
US-8791257-B2 Substituted pyrrolotriazines as protein kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-07-29 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-11046686-B2 Thiadiazole IRAK4 compounds IRAK4, IRAK3, IRAK2 EPHX1 2893/4885PDK1 173/4885PDK2 417/4885
US-11702414-B2 Thiadiazole IRAK4 inhibitors IRAK4, IRAK3, IRAK1 EPHX1 2632/4885PDK1 189/4885PDK2 475/4885
US-20220402910-A1 THIADIAZOLE IRAK4 INHIBITORS IRAK4, IRAK3, IRAK1 EPHX1 2632/4885PDK1 189/4885PDK2 475/4885

“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.