SCHEMBL25858704

SCHEMBL25858704

CC(C)N1C2CC1CN(C(=O)C1CCN(C)CC1)C2

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.48
HTT P42858 1/20 0.41
LMNA P02545 1/20 0.41
CHRNB2 P17787 6/20 0.39
CHRNA3 P32297 6/20 0.39
CHRNA4 P43681 6/20 0.39
CHRNB3 Q05901 4/20 0.39
CHRNA6 Q15825 4/20 0.39
CHRNB4 P30926 2/20 0.36
CHRNA7 P36544 2/20 0.36
ALDH1A1 P00352 3/20 0.36
HSD11B1 P28845 3/20 0.35
TSHR P16473 1/20 0.34
HPGD P15428 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL21738149 0.87 HRH3 (0.39) HRH3HTTLMNACHRNB2CHRNA3
SCHEMBL26139061 0.84 HRH3 (0.45) HRH3CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL21738148 0.81 HRH3 (0.43) HRH3LMNACHRNB2CHRNA3CHRNA4
SCHEMBL21846690 0.80 HRH3 (0.47) HRH3HTTCHRNB2CHRNA3CHRNA4
SCHEMBL23583246 0.78 HRH3 (0.41) HRH3HSD11B1
SCHEMBL14471383 0.77 HRH3 (0.60) HRH3HTTLMNAALDH1A1TSHR
SCHEMBL26790076 0.77 HTT (0.46) HRH3HTTLMNACHRNB2CHRNA3
SCHEMBL26139057 0.76 ATM (0.38) HRH3CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL21738123 0.75 HRH3 (0.41) HRH3HTTLMNAALDH1A1
SCHEMBL13621132 0.74 HTT (0.50) HRH3HTTLMNACHRNB2CHRNA3

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 2 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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 932/4885HTT 3929/4885LMNA 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.