SCHEMBL27012452

SCHEMBL27012452

CC(C)N1CCC2(CC1)CN(C[C@H]1CCN(C(C)C)C1)C2

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 1/20 0.34
TLR8 Q9NR97 1/20 0.34
TLR7 Q9NYK1 1/20 0.34
HRH3 Q9Y5N1 6/20 0.33
CCR2 P41597 1/20 0.32
KCNH2 Q12809 1/20 0.32
CYP2D6 P10635 1/20 0.30

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
SCHEMBL27012450 1.00 TLR9 (0.34) TLR9TLR8TLR7HRH3CCR2
SCHEMBL22520631 0.92 HRH3 (0.35) TLR9TLR8TLR7HRH3KCNH2
SCHEMBL27013290 0.89 HRH3 (0.33) HRH3CYP2D6
SCHEMBL27012443 0.89 HRH3 (0.33) HRH3CYP2D6
SCHEMBL27012454 0.88 TLR9 (0.36) TLR9TLR8TLR7HRH3CCR2
SCHEMBL27027629 0.88 TLR9 (0.36) TLR9TLR8TLR7HRH3CCR2
SCHEMBL27012455 0.87 TLR9 (0.35) TLR9TLR8TLR7HRH3CCR2
SCHEMBL24233104 0.87 TSHR (0.35) TLR9TLR8TLR7HRH3CCR2
SCHEMBL24475321 0.85 HRH3 (0.32) HRH3
SCHEMBL27016087 0.85 HRH3 (0.32) HRH3

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-20240018123-A1 COMPOUND FOR INHIBITING OR DISINTEGRATING ANDROGEN RECEPTOR, AND PHARMACEUTICAL USE THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2024-01-18 US disclosed
US-20240018123-A1 COMPOUND FOR INHIBITING OR DISINTEGRATING ANDROGEN RECEPTOR, AND PHARMACEUTICAL USE THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2024-01-18 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-20240018123-A1 COMPOUND FOR INHIBITING OR DISINTEGRATING ANDROGEN RECEPTOR, AND PHARMACEUTICAL USE THEREOF AR, NR5A1, SHBG TLR9 1017/4885TLR8 1370/4885TLR7 2399/4885

“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.