SCHEMBL3299793

SCHEMBL3299793

CCCCCc1ccc(C(=O)Nc2cccc3cc4cccc5c4c(c23)C(=O)N(CCN(C)C)C5=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 3/20 0.46
▸ FTO Q9C0B1 3/20 0.46
▸ HEXA P06865 1/20 0.45
▸ HEXB P07686 1/20 0.45
▸ CYP2D6 P10635 1/20 0.44
▸ PLK1 P53350 9/20 0.44
▸ PLK3 Q9H4B4 7/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ PABPC1 P11940 1/20 0.42
▸ NR1I2 O75469 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ AHR P35869 1/20 0.41
▸ RAD52 P43351 1/20 0.41
▸ RCE1 Q9Y256 1/20 0.41
▸ THRA P10827 2/20 0.41
▸ THRB P10828 2/20 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
SCHEMBL3302563 0.94 HEXA (0.47) TRPV1FTOHEXAHEXBCYP2D6
SCHEMBL3294784 0.87 FTO (0.54) FTOHEXAHEXBCYP2D6PLK1
SCHEMBL3296718 0.84 HDAC3 (0.50) FTOHEXAHEXBCYP2D6ALDH1A1
SCHEMBL3299473 0.84 FTO (0.51) FTOHEXAHEXBCYP2D6ALDH1A1
SCHEMBL3297122 0.84 HDAC3 (0.52) FTOHEXAHEXBCYP2D6ALDH1A1
SCHEMBL3300095 0.83 FTO (0.49) FTOHEXAHEXBCYP2D6PABPC1
SCHEMBL3302098 0.81 HEXA (0.47) FTOHEXAHEXBCYP2D6ALDH1A1
SCHEMBL14528306 0.81 HEXA (0.47) FTOHEXAHEXBCYP2D6ALDH1A1
SCHEMBL3300198 0.81 HEXA (0.53) FTOHEXAHEXBCYP2D6ALDH1A1
SCHEMBL13297981 0.81 HEXA (0.48) FTOHEXAHEXBCYP2D6ALDH1A1

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 3 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 disclosed
US-20080292585-A1 Azonafide Derivatives, Methods for Their Production and Pharmaceutical Compositions Therefrom UNIBIOSCREEN S.A. (BE) 2008-11-27 — — US disclosed
EP-1787985-A1 Azonafide derivatives, methods for their production and pharmaceutical compositions therefrom Unibioscreen S.A. (BE) 2007-05-23 — — 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-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 TRPV1 1912/4885FTO 595/4885HEXA 1944/4885

“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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