SCHEMBL21085128

SCHEMBL21085128

CCC(O)C1C[CH]CCC1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.35
TP53 P04637 1/20 0.33
KDM4E B2RXH2 1/20 0.32
GMNN O75496 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL21085127 0.85 TP53 (0.31) TP53KDM4EGMNNLMNAMAPT
SCHEMBL21085028 0.82 METAP1 (0.34)
SCHEMBL4959409 0.79 SHBG (0.33) SHBGTP53KDM4EGMNNLMNA
SCHEMBL9979221 0.78 SHBG (0.37) SHBG
SCHEMBL1183815 0.77 SHBG (0.38) SHBGTP53KDM4EGMNNLMNA
SCHEMBL27816603 0.77 TP53 (0.39) TP53KDM4EGMNNLMNAMAPT
SCHEMBL1183817 0.77 SHBG (0.38) SHBGTP53KDM4EGMNNLMNA
SCHEMBL27816582 0.77 TP53 (0.39) TP53KDM4EGMNNLMNAMAPT
SCHEMBL16621837 0.75
SCHEMBL130751 0.75

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-10759749-B2 Therapeutic agent for diabetes JCR PHARMACEUTICALS CO., LTD. (JP) 2020-09-01 US disclosed
EP-3508474-A1 NOVEL THERAPEUTIC AGENT FOR DIABETES JCR Pharmaceuticals Co., Ltd. (JP) 2019-07-10 EP disclosed
US-20190202781-A1 NOVEL THERAPEUTIC AGENT FOR DIABETES JCR PHARMACEUTICALS CO., LTD. (JP) 2019-07-04 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 (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-20190202781-A1 NOVEL THERAPEUTIC AGENT FOR DIABETES GPR119, IAPP, DPP4 SHBG 931/4885TP53 3795/4885KDM4E 2508/4885
US-10759749-B2 Therapeutic agent for diabetes GPR119, IAPP, DPP4 SHBG 207/4885TP53 2642/4885KDM4E 1987/4885

“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.