SCHEMBL21290423

SCHEMBL21290423

CC(C)OC[C@H]1CCC(=O)N1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 19/20 0.40
KCNH2 Q12809 1/20 0.40
CTSD P07339 1/20 0.35

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
SCHEMBL18084625 1.00 IRAK4 (0.40) IRAK4KCNH2CTSD
SCHEMBL21507384 1.00 IRAK4 (0.40) IRAK4KCNH2CTSD
SCHEMBL5994524 0.89 IRAK4 (0.42) IRAK4KCNH2CTSD
SCHEMBL22354600 0.89 IRAK4 (0.42) IRAK4KCNH2CTSD
SCHEMBL9865626 0.83 LMNA (0.39) IRAK4KCNH2CTSD
SCHEMBL5215585 0.83 LMNA (0.39) IRAK4KCNH2CTSD
SCHEMBL22259093 0.82 IRAK4 (0.34) IRAK4KCNH2CTSD
SCHEMBL20143953 0.82 IRAK4 (0.33) IRAK4KCNH2
SCHEMBL9851971 0.79 IRAK4 (0.38) IRAK4KCNH2
SCHEMBL9851972 0.79 IRAK4 (0.38) IRAK4KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-09-28 US disclosed
US-20230212155-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. 2023-07-06 US disclosed
EP-4026835-A2 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2022-07-13 EP disclosed
US-20210323922-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. (US) 2021-10-21 US disclosed
US-20190345131-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. 2019-11-14 US disclosed
WO-2019204609-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. (US) 2019-10-24 WO disclosed
WO-2019160882-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. (US) 2019-08-22 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-20210323922-A1 PD-1/PD-L1 INHIBITORS CD274, PDCD1, PDCD1LG2 IRAK4 1382/4885KCNH2 4053/4885CTSD 2998/4885
US-20230212155-A1 PD-1/PD-L1 INHIBITORS PDCD1, CD274, PDCD1LG2 IRAK4 1881/4885KCNH2 4081/4885CTSD 3170/4885
US-20190345131-A1 PD-1/PD-L1 INHIBITORS PDCD1, CD274, PDCD1LG2 IRAK4 1093/4885KCNH2 4309/4885CTSD 2372/4885
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 IRAK4 4/4885KCNH2 4751/4885CTSD 817/4885

“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.