SCHEMBL25858258

SCHEMBL25858258

Brc1nnc(N2CCN3CCOC[C@H]3C2)s1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.37
SOS1 Q07889 10/20 0.33
LRRK2 Q5S007 1/20 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
SCHEMBL21738049 1.00 HRH3 (0.37) HRH3SOS1LRRK2
SCHEMBL21738043 1.00 HRH3 (0.37) HRH3SOS1LRRK2
SCHEMBL25858317 0.83 HRH3 (0.38) HRH3
SCHEMBL25859539 0.72 RAB9A (0.42)
SCHEMBL30644279 0.71 LRRK2 (0.36) SOS1LRRK2
SCHEMBL21738060 0.71 HRH3 (0.31) HRH3
SCHEMBL30644253 0.71 AKR1C3 (0.47) HRH3SOS1
SCHEMBL31276654 0.71 AKR1C3 (0.47) HRH3SOS1
SCHEMBL30644271 0.69 AKR1C3 (0.51) SOS1LRRK2
SCHEMBL21738058 0.65

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 932/4885SOS1 1295/4885LRRK2 197/4885

“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.