SCHEMBL3298317

SCHEMBL3298317

CN(C)CCN1C(=O)c2cccc3cc4cccc(NC(=S)Nc5ccc(C(F)(F)F)cc5)c4c(c23)C1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HEXA P06865 1/20 0.46
▸ HEXB P07686 1/20 0.46
▸ PLK1 P53350 1/20 0.45
▸ FTO Q9C0B1 3/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ PABPC1 P11940 1/20 0.42
▸ POLB P06746 2/20 0.40
▸ NR1I2 O75469 1/20 0.40
▸ AHR P35869 1/20 0.40
▸ RAD52 P43351 1/20 0.40
▸ RCE1 Q9Y256 1/20 0.40
▸ MAPT P10636 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ CYP1A2 P05177 2/20 0.37
▸ CYP3A4 P08684 1/20 0.37

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
SCHEMBL3299760 0.89 HEXA (0.44) HEXAHEXBFTOCYP2D6PABPC1
SCHEMBL3298493 0.89 HEXA (0.48) HEXAHEXBFTOCYP2D6PABPC1
SCHEMBL3302233 0.89 HEXA (0.48) HEXAHEXBFTOCYP2D6PABPC1
SCHEMBL3298903 0.87 HEXA (0.47) HEXAHEXBFTOCYP2D6PABPC1
SCHEMBL3295868 0.87 LMNA (0.49) HEXAHEXBPLK1FTOCYP2D6
SCHEMBL3294679 0.86 HEXA (0.46) HEXAHEXBFTOCYP2D6PABPC1
SCHEMBL3296133 0.84 HEXA (0.45) HEXAHEXBPLK1FTOCYP2D6
SCHEMBL3295981 0.84 MAPT (0.46) HEXAHEXBFTOCYP2D6PABPC1
SCHEMBL3296036 0.83 FTO (0.48) HEXAHEXBFTOCYP2D6PABPC1
SCHEMBL3302695 0.83 HEXA (0.52) HEXAHEXBPLK1FTOCYP2D6

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
US-7741337-B2 Azonafide derivatives, methods for their production and pharmaceutical compositions therefrom UNIBIOSCREEN S.A. (BE) 2010-06-22 — — US claimed
US-20080292585-A1 Azonafide Derivatives, Methods for Their Production and Pharmaceutical Compositions Therefrom UNIBIOSCREEN S.A. (BE) 2008-11-27 — — US claimed
US-7741337-B2 Azonafide derivatives, methods for their production and pharmaceutical compositions therefrom UNIBIOSCREEN S.A. (BE) 2010-06-22 — — US disclosed
US-7741337-B2 Azonafide derivatives, methods for their production and pharmaceutical compositions therefrom UNIBIOSCREEN S.A. (BE) 2010-06-22 — — US disclosed
US-7741337-B2 Azonafide derivatives, methods for their production and pharmaceutical compositions therefrom UNIBIOSCREEN S.A. (BE) 2010-06-22 — — US disclosed
US-20080292585-A1 Azonafide Derivatives, Methods for Their Production and Pharmaceutical Compositions Therefrom UNIBIOSCREEN S.A. (BE) 2008-11-27 — — US disclosed
US-20080292585-A1 Azonafide Derivatives, Methods for Their Production and Pharmaceutical Compositions Therefrom UNIBIOSCREEN S.A. (BE) 2008-11-27 — — US disclosed
US-20080292585-A1 Azonafide Derivatives, Methods for Their Production and Pharmaceutical Compositions Therefrom UNIBIOSCREEN S.A. (BE) 2008-11-27 — — US disclosed
WO-2007054292-A2 AZONAFIDE DERIVATIVES, METHODS FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS THEREFROM UNIBIOSCREEN S.A. (BE) 2007-05-18 — — 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-20080292585-A1 Azonafide Derivatives, Methods for Their Production and Pharmaceutical Compositions Therefrom AADAC, NOTUM, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 HEXA 1944/4885HEXB 2802/4885PLK1 4654/4885

“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.

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