SCHEMBL15978281

SCHEMBL15978281

C=CCc1cc(C)c(C/C=C(\C)CC(C)C)cc1OCOC

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
MAPK1 P28482 1/20 0.31
KDM4E B2RXH2 1/20 0.30
LMNA P02545 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
SCHEMBL806751 0.94 KDM4E (0.33) IMPDH2L3MBTL1MAPK1KDM4ELMNA
SCHEMBL15978362 0.82 APP (0.42) MAPK1LMNA
SCHEMBL806720 0.81 HTR2A (0.34) IMPDH2
SCHEMBL806744 0.80 KDM4E (0.38) IMPDH2L3MBTL1MAPK1KDM4E
SCHEMBL806903 0.75 BACE1 (0.42) MAPK1LMNA
SCHEMBL15978363 0.72 CNR2 (0.34) L3MBTL1MAPK1KDM4ELMNA
SCHEMBL15978280 0.70 IMPDH2 (0.35) IMPDH2
SCHEMBL806897 0.69 CYP3A4 (0.38) KDM4E
SCHEMBL806745 0.66 IMPDH2 (0.34) IMPDH2LMNA
SCHEMBL15978364 0.65 APP (0.44) IMPDH2MAPK1LMNA

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-20140243404-A1 UNIQUE HALOGEN-INDUCED CYCLIZATIONS, REAGENTS THEREFOR, AND COMPOUNDS PRODUCED THEREBY THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2014-08-28 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-20140243404-A1 UNIQUE HALOGEN-INDUCED CYCLIZATIONS, REAGENTS THEREFOR, AND COMPOUNDS PRODUCED THEREBY WEE1, WEE2, NOTUM IMPDH2 2395/4885L3MBTL1 518/4885MAPK1 2458/4885

“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.