SCHEMBL6898974

SCHEMBL6898974

C=CCOc1ccc2c(C)cc(=O)oc2c1C(C)=O

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.70
ALDH1A1 P00352 6/20 0.58
MAPT P10636 4/20 0.58
HPGD P15428 2/20 0.58
HTR1A P08908 8/20 0.58
HTR2A P28223 6/20 0.58
GAA P10253 5/20 0.55
KMT2A Q03164 4/20 0.55
POLB P06746 1/20 0.54
LMNA P02545 1/20 0.54
MEN1 O00255 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL6901789 0.88 KDM4E (0.74) KDM4EALDH1A1MAPTHPGDHTR1A
SCHEMBL6904922 0.87 KDM4E (0.69) KDM4EALDH1A1MAPTHTR1AHTR2A
SCHEMBL11076838 0.87 KDM4E (0.69) KDM4EALDH1A1MAPTHTR1AHTR2A
SCHEMBL4390489 0.85 KDM4E (0.79) KDM4EALDH1A1MAPTHPGDGAA
SCHEMBL6903392 0.83 MAPT (0.56) KDM4EALDH1A1MAPTHPGDHTR1A
SCHEMBL29963486 0.82 KDM4E (1.00) KDM4EALDH1A1MAPTHPGDHTR1A
SCHEMBL27079807 0.82 KDM4E (1.00) KDM4EALDH1A1MAPTHPGDHTR1A
SCHEMBL8876001 0.82 KDM4E (0.76) KDM4EALDH1A1MAPTHPGDHTR1A
SCHEMBL6901231 0.81 MAPT (0.56) KDM4EALDH1A1MAPTHPGDHTR1A
SCHEMBL11313571 0.81 KDM4E (0.66) KDM4EALDH1A1MAPTHPGDGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6767916-B2 1-(4-METHYL-7-(3-METHYLBUT-2-ENYLOXY)COUMARIN-8-YL)-3-(PYRIDIN E-3-YL)- PROPEN-1-ONE FOR EXAMPLE; ANTIPROLIFERATIVE AGENT; TUMOR, CANCER TREATMENT INDENA S.P.A. (IT) 2004-07-27 US disclosed
EP-1212311-B1 CHALCONE COUMARINS INDENA SPA (IT) 2003-03-26 EP disclosed
US-20020161036-A1 1-(4-methyl-7-(3-methylbut-2-enyloxy)coumarin-8-yl)-3-(pyridin e-3-yl)- propen-1-one for example; antiproliferative agent; tumor, cancer treatment INDENA S.P.A. (IT) 2002-10-31 US disclosed
EP-1212311-A1 CHALCONE COUMARINS INDENA S.p.A. (IT) 2002-06-12 EP disclosed
WO-2001017984-A1 CHALCONE COUMARINS INDENA S.P.A. (IT) 2001-03-15 WO disclosed
EP-0108036-A1 Benzopyranones CIBA-GEIGY AG (CH) 1984-05-09 EP 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-20020161036-A1 1-(4-methyl-7-(3-methylbut-2-enyloxy)coumarin-8-yl)-3-(pyridin e-3-yl)- propen-1-one for example; antiproliferative agent; tumor, cancer treatment NFKBIA, MKI67, HPD KDM4E 201/4885ALDH1A1 1741/4885MAPT 4371/4885

“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.