SCHEMBL10042275

SCHEMBL10042275

C=C[C@H]1[C@H](C)OC=C2C(=O)OCC[C@H]21

nearest known ligand 0.50

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.50

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
SCHEMBL29425858 0.87 STAT3 (0.41) STAT3
SCHEMBL31371996 0.82 STAT3 (0.56) STAT3
SCHEMBL13998201 0.82 STAT3 (0.56) STAT3
Sweroside SCHEMBL307117 0.68 STAT3 (1.00) STAT3
SCHEMBL14010720 0.65 STAT3 (0.40) STAT3
SCHEMBL14010917 0.59 STAT3 (0.40) STAT3
SCHEMBL8398637 0.55 — —
SCHEMBL23855448 0.54 HRH3 (0.33) —
SCHEMBL9181141 0.53 BCL2L1 (0.35) —
SCHEMBL30874263 0.53 MAOA (0.42) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8093288-B2 Genipin derivatives and uses thereof BETH ISRAEL DEACONESS MEDICAL CENTER (US) 2012-01-10 — — US disclosed
US-20100168160-A1 Genipin Derivatives and Uses Thereof BETH ISRAEL DEACONESS MEDICAL CENTER , INC. AND TRUSTEES OF BOSTON UNIVERSITY (US) 2010-07-01 — — US disclosed
US-7649014-B2 Genipin derivatives and uses thereof BETH ISRAEL DEACONESS MEDICAL CENTER, INC. (US) 2010-01-19 — — US disclosed
US-20080319042-A1 Compositions and methods for treatment of liver disease CALECO PHARMA CORP. 2008-12-25 — — US disclosed
US-20080009450-A9 Genipin derivatives and uses thereof ZHANG CHEN-YU 2008-01-10 — — 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 (3 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-20080319042-A1 Compositions and methods for treatment of liver disease HCCS, HAVCR2, PYGL STAT3 3954/4885
US-20080009450-A9 Genipin derivatives and uses thereof GPR119, PCK2, UCK2 STAT3 3682/4885
US-20100168160-A1 Genipin Derivatives and Uses Thereof GPR119, PCK2, UCK2 STAT3 3682/4885

“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.

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