SCHEMBL25525889

SCHEMBL25525889

COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4cc[n+](CCC[N+](C)(C)C)cc4)c4nsnc34)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 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
Bromide SCHEMBL25229945 0.99 CHRM2 (0.31) CRHR1
Bromide SCHEMBL25229944 0.99 CRHR1 (0.30) CRHR1
SCHEMBL25525887 0.89 CHRM2 (0.36)
Bromide SCHEMBL25267190 0.88 CHRM2 (0.36)
Bromide SCHEMBL25205717 0.88 CHRM2 (0.36)
Bromide SCHEMBL25267189 0.88 CHRM2 (0.38)
SCHEMBL25525868 0.88 HTT (0.32)
SCHEMBL25525880 0.88 ESR1 (0.32)
Bromide SCHEMBL25201808 0.87 HTT (0.31)
Bromide SCHEMBL25236615 0.87 CHRM2 (0.32)

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-20230165978-A1 Composition and A Method For Diagnosing And Treating Bacterial Infection Hong Kong Centre for Cerebro-Cardiovascular Health Engineering Limited (HK) 2023-06-01 US disclosed
US-20230165978-A1 Composition and A Method For Diagnosing And Treating Bacterial Infection Hong Kong Centre for Cerebro-Cardiovascular Health Engineering Limited (HK) 2023-06-01 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-20230165978-A1 Composition and A Method For Diagnosing And Treating Bacterial Infection NOD2, PYCARD, NOD1 CRHR1 4736/4885

“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.