SCHEMBL25882147

SCHEMBL25882147

COC(=O)C1CCCCN1C(c1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.65
SLC6A3 Q01959 3/20 0.49
SLC6A2 P23975 1/20 0.49
SLC6A4 P31645 1/20 0.49
MDM2 Q00987 1/20 0.43
SLC6A9 P48067 1/20 0.43
GPX4 P36969 1/20 0.43

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
SCHEMBL25881972 0.87 TSHR (0.50) TSHRSLC6A3SLC6A4
SCHEMBL25983199 0.82 TSHR (0.50) TSHRSLC6A3SLC6A2SLC6A4
SCHEMBL21831116 0.80 TSHR (0.48) TSHRSLC6A3SLC6A2SLC6A4SLC6A9
SCHEMBL7067185 0.78 TSHR (0.58) TSHRSLC6A3SLC6A2SLC6A4MDM2
SCHEMBL6232174 0.78 TSHR (0.58) TSHRSLC6A3SLC6A2SLC6A4MDM2
SCHEMBL6231109 0.78 TSHR (0.58) TSHRSLC6A3SLC6A2SLC6A4MDM2
SCHEMBL2770710 0.76 KMT2A (0.48) TSHRSLC6A3SLC6A2SLC6A4
SCHEMBL21831014 0.75 MEN1 (0.47) TSHRSLC6A9GPX4
SCHEMBL7959764 0.75 TSHR (0.51) TSHRSLC6A3SLC6A2SLC6A4
SCHEMBL7973175 0.75 TSHR (0.51) TSHRSLC6A3SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-01 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-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG TSHR 2365/4885SLC6A3 4255/4885SLC6A2 4722/4885

“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.