SCHEMBL6903967

SCHEMBL6903967

C=CCOc1ccc2c(C)cc(=O)oc2c1C(=O)C=Cc1cccnc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.51
LMNA P02545 4/20 0.51
KMT2A Q03164 1/20 0.51
HTT P42858 3/20 0.50
GAA P10253 2/20 0.50
SRC P12931 1/20 0.50
PLIN1 O60240 1/20 0.50
RAB9A P51151 1/20 0.50
PLIN5 Q00G26 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ABHD5 Q8WTS1 1/20 0.50
KDM4E B2RXH2 6/20 0.47
HPGD P15428 3/20 0.47
ALDH1A1 P00352 5/20 0.44
POLB P06746 1/20 0.44
NPC1 O15118 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
CYP1A1 P04798 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP1B1 Q16678 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
SCHEMBL7172080 0.90 MAPT (0.50) MAPTLMNAKMT2AHTTGAA
SCHEMBL6903392 0.89 MAPT (0.56) MAPTLMNAKMT2AHTTGAA
SCHEMBL6899190 0.89 KDM4E (0.52) MAPTLMNAKMT2AHTTGAA
SCHEMBL6901796 0.87 MAPT (0.49) MAPTLMNAKMT2AHTTGAA
SCHEMBL7173515 0.84 MAPT (0.58) MAPTLMNAKMT2AHTTGAA
SCHEMBL6901783 0.84 MAPT (0.52) MAPTLMNAKMT2AHTTGAA
SCHEMBL6901231 0.84 MAPT (0.56) MAPTLMNAKMT2AHTTGAA
SCHEMBL7177555 0.81 MAPT (0.48) MAPTLMNAKMT2AHTTGAA
SCHEMBL6898972 0.79 KDM4E (0.57) MAPTLMNAKMT2AHTTGAA
SCHEMBL7632804 0.79 KDM4E (0.61) MAPTLMNAKMT2AHTTGAA

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 10 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 claimed
EP-1212311-B1 CHALCONE COUMARINS INDENA SPA (IT) 2003-03-26 EP claimed
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 claimed
EP-1212311-A1 CHALCONE COUMARINS INDENA S.p.A. (IT) 2002-06-12 EP claimed
WO-2001017984-A1 CHALCONE COUMARINS INDENA S.P.A. (IT) 2001-03-15 WO claimed
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

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 MAPT 4371/4885LMNA 3048/4885KMT2A 1899/4885

“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.