SCHEMBL7070733

SCHEMBL7070733

C=CCOc1ccc2c(=O)c(C)c(-c3ccccc3)oc2c1C(=O)C=Cc1cccc(OC)c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 2/20 0.45
BCHE P06276 1/20 0.43
FLT3 P36888 1/20 0.43
MAOB P27338 6/20 0.42
ABCG2 Q9UNQ0 2/20 0.42
KCNA3 P22001 2/20 0.41
MAOA P21397 2/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 1/20 0.39
ABCB1 P08183 1/20 0.39
SRC P12931 1/20 0.39
PLIN1 O60240 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
PLIN5 Q00G26 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ABHD5 Q8WTS1 1/20 0.39

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
SCHEMBL7069986 0.91 ABCB1 (0.46) NQO1BCHEMAOBABCG2KCNA3
SCHEMBL7070595 0.91 MAOB (0.40) FLT3MAOBMAOALMNAMAPT
SCHEMBL7073634 0.90 NQO1 (0.45) NQO1BCHEMAOBABCG2KCNA3
SCHEMBL7072948 0.88 KRAS (0.43) ABCG2LMNAMAPTKMT2AABCB1
SCHEMBL7173515 0.83 MAPT (0.58) NQO1FLT3MAOBABCG2KCNA3
SCHEMBL7068041 0.83 ALDH1A1 (0.44) MAOBMAOALMNAMAPTKMT2A
SCHEMBL7073297 0.81 MAOB (0.43) MAOBMAOALMNAMAPTKMT2A
SCHEMBL7072943 0.80 ALDH1A1 (0.41) MAOBMAOALMNAMAPTABCB1
SCHEMBL7072240 0.79 ALOX5 (0.50) LMNAMAPTKMT2AABCB1PLIN1
SCHEMBL7186435 0.78 PADI4 (0.41) MAOBMAOALMNAMAPTABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1212315-B1 NOVEL CHALCONES INDENA SPA (IT) 2003-03-26 EP claimed
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 claimed
EP-1212315-A1 NOVEL CHALCONES INDENA S.p.A. (IT) 2002-06-12 EP claimed
WO-2001017988-A1 NOVEL CHALCONES INDENA S.P.A. (IT) 2001-03-15 WO claimed
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 NQO1 1090/4885BCHE 2659/4885FLT3 3744/4885

“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.