SCHEMBL24958950

SCHEMBL24958950

Clc1cnc(COc2cccc(Br)n2)s1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPM5 Q9NZQ8 13/20 0.45
HTR7 P34969 1/20 0.43
TRPA1 O75762 3/20 0.33
CDK9 P50750 1/20 0.31
DYRK1A Q13627 1/20 0.31
DYRK2 Q92630 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
ACACB O00763 2/20 0.31
TRPM4 Q8TD43 1/20 0.31
KDR P35968 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL30029030 1.00 TRPM5 (0.45) TRPM5HTR7TRPA1CDK9DYRK1A
SCHEMBL30027964 0.79 HTR7 (0.43) HTR7KDM4E
SCHEMBL24959005 0.79 HTR7 (0.43) HTR7KDM4E
SCHEMBL30028670 0.79 HTR7 (0.40) TRPM5HTR7
SCHEMBL24958754 0.79 HTR7 (0.40) TRPM5HTR7
SCHEMBL24958881 0.79 HTR7 (0.40) HTR7KDR
SCHEMBL24956474 0.79 HTR7 (0.40) HTR7HDAC6KDR
SCHEMBL30028274 0.77 HTR7 (0.42) HTR7CDK9DYRK1ADYRK2
SCHEMBL24958798 0.77 HTR7 (0.42) HTR7CDK9DYRK1ADYRK2
SCHEMBL24958762 0.74 TRPM5 (0.43) TRPM5TRPA1HDAC6ACACB

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
CN-117295729-A Carboxy-benzimidazole GLP-1R modulating compounds 吉利德科学公司 2023-12-26 CN disclosed
US-20230021705-A1 GLP-1R MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2023-01-26 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-20230021705-A1 GLP-1R MODULATING COMPOUNDS GLP1R, GIPR, GPR119 TRPM5 1457/4885HTR7 280/4885TRPA1 2037/4885

“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.