SCHEMBL21869178

SCHEMBL21869178

Nc1c(Cl)c(C(=O)Nc2ccnc(F)c2)n2c1CCC2

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 1/20 0.42
SLC10A1 Q14973 17/20 0.40
GRM5 P41594 1/20 0.37
JAK2 O60674 1/20 0.37
TYK2 P29597 1/20 0.37

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
SCHEMBL21868966 0.89 SMARCA2 (0.42) SLC10A1GRM5JAK2TYK2
SCHEMBL21869051 0.85 SMARCA2 (0.41) SCN10AGRM5JAK2TYK2
SCHEMBL21869151 0.84 SLC10A1 (0.52) SLC10A1
SCHEMBL22646308 0.74 ALDH1A1 (0.39) SLC10A1
SCHEMBL30095104 0.71 SLC10A1 (0.50) SCN10ASLC10A1
SCHEMBL21868876 0.71 SLC10A1 (0.51) SLC10A1
SCHEMBL30094969 0.70 SLC10A1 (0.45) SCN10ASLC10A1
SCHEMBL21869113 0.68 SLC10A1 (0.48) SLC10A1
SCHEMBL21868867 0.68 SLC10A1 (0.50) SLC10A1
SCHEMBL21868951 0.68 ALDH1A1 (0.40)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11591334-B2 Substituted pyrrolizines for the treatment of hepatitis B SHANGHAI LONGWOOD BIOPHARMACEUTICALS CO., LTD. (CN) 2023-02-28 US disclosed
US-20200354366-A1 BICYCLIC NUCLEOCAPSID INHIBITOR AND USE OF SAME AS DRUG IN TREATMENT OF HEPATITIS B SHANGHAI LONGWOOD BIOPHARMACEUTICALS CO., LTD. (CN) 2020-11-12 US disclosed
EP-3628674-A1 BICYCLIC NUCLEOCAPSID INHIBITOR AND USE OF SAME AS DRUG IN TREATMENT OF HEPATITIS B Shanghai Longwood Biopharmaceuticals Co., Ltd. (CN) 2020-04-01 EP 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-11591334-B2 Substituted pyrrolizines for the treatment of hepatitis B SLC10A1, NUP188, NR1H4 SCN10A 3380/4885SLC10A1 1/4885GRM5 2778/4885
US-20200354366-A1 BICYCLIC NUCLEOCAPSID INHIBITOR AND USE OF SAME AS DRUG IN TREATMENT OF HEPATITIS B SLC10A1, NR1H4, NUP188 SCN10A 1979/4885SLC10A1 1/4885GRM5 3325/4885

“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.