SCHEMBL7073740

SCHEMBL7073740

CC(=O)c1c(OCC=C(C)C)ccc2c(=O)c3ccccc3oc12

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.51
ALOX15 P16050 4/20 0.48
KDM4E B2RXH2 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
IKBKB O14920 1/20 0.45
PTGS2 P35354 1/20 0.44
CA12 O43570 2/20 0.41
CA9 Q16790 2/20 0.41
VKORC1 Q9BQB6 1/20 0.41

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
SCHEMBL7068663 0.88 CA12 (0.52) MAOAKDM4ENPC1RAB9AALDH1A1
SCHEMBL7072951 0.87 MAOB (0.45) MAOAALOX15KDM4ENPC1RAB9A
SCHEMBL7184162 0.85 MAOA (0.52) MAOAKDM4ENPC1RAB9AALDH1A1
SCHEMBL7067921 0.83 NQO1 (0.49) MAOAKDM4ENPC1RAB9AALDH1A1
SCHEMBL7070727 0.81 ALOX5 (0.53) MAOAKDM4EALDH1A1LMNA
SCHEMBL7067916 0.80 KDM4E (0.46) MAOAKDM4EALDH1A1LMNACA9
SCHEMBL3326973 0.76 ALOX15 (0.50) MAOAALOX15KDM4EALDH1A1LMNA
SCHEMBL6901789 0.76 KDM4E (0.74) KDM4EALDH1A1LMNA
SCHEMBL7070719 0.73 CA12 (0.46) MAOAKDM4ENPC1RAB9AALDH1A1
SCHEMBL9836804 0.72 MAOA (0.56) MAOAKDM4ENPC1RAB9AALDH1A1

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-6620842-B2 Chalcones INDENA SPA (IT) 2003-09-16 US disclosed
EP-1212315-B1 NOVEL CHALCONES INDENA SPA (IT) 2003-03-26 EP disclosed
US-20030055056-A1 For use as antitumor and immune suppressive agents, as inhibitors of proliferative cell growth and as prophylactic agents to inhibit and prevent cancer and non-malignant cell growth INDENA S.P.A. (IT) 2003-03-20 US disclosed
EP-1212315-A1 NOVEL CHALCONES INDENA S.p.A. (IT) 2002-06-12 EP disclosed
WO-2001017988-A1 NOVEL CHALCONES 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-20030055056-A1 For use as antitumor and immune suppressive agents, as inhibitors of proliferative cell growth and as prophylactic agents to inhibit and prevent cancer and non-malignant cell growth HDGF, MKI67, HPD MAOA 3276/4885ALOX15 2128/4885KDM4E 397/4885

“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.