SCHEMBL21738110

SCHEMBL21738110

CC(C)N1CC2CC(C1)N2C(=O)C1CCN(C2COC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.39
PIK3CD O00329 1/20 0.35
LMNA P02545 2/20 0.34
PRMT5 O14744 4/20 0.33
WDR77 Q9BQA1 4/20 0.33
WNT1 P04628 1/20 0.32
GSK3B P49841 1/20 0.32
DYRK1A Q13627 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MAP3K12 Q12852 2/20 0.31

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
SCHEMBL20070420 0.83 PIK3CD (0.49) HRH3PIK3CD
SCHEMBL20071302 0.82 HRH3 (0.40) HRH3PIK3CD
SCHEMBL21738123 0.81 HRH3 (0.41) HRH3PIK3CDLMNA
SCHEMBL20154481 0.80 PIK3CD (0.40) HRH3PIK3CD
SCHEMBL21738120 0.80 HRH3 (0.43) HRH3
SCHEMBL20148607 0.79 RECQL (0.44) HRH3PIK3CD
SCHEMBL20071310 0.79 RECQL (0.44) HRH3PIK3CD
SCHEMBL21738111 0.79 HRH3 (0.46) HRH3PIK3CD
SCHEMBL21738148 0.78 HRH3 (0.43) HRH3LMNAWNT1GSK3BDYRK1A
SCHEMBL20071315 0.78 PIK3CD (0.40) HRH3PIK3CDLMNA

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-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
WO-2020036986-A1 THIADIAZOLE IRAK4 INHIBITORS GILEAD SCIENCES, INC. (US) 2020-02-20 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 (2 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-11702414-B2 Thiadiazole IRAK4 inhibitors IRAK4, IRAK3, IRAK1 HRH3 932/4885PIK3CD 252/4885LMNA 2869/4885
US-20220402910-A1 THIADIAZOLE IRAK4 INHIBITORS IRAK4, IRAK3, IRAK1 HRH3 932/4885PIK3CD 252/4885LMNA 2869/4885

“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.