SCHEMBL4816908

SCHEMBL4816908

[CH2]/C=C/c1cccc(-n2ccnc2)c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.55
CYP3A4 P08684 2/20 0.51
CYP11B1 P15538 3/20 0.47
CYP11B2 P19099 2/20 0.47
CYP19A1 P11511 2/20 0.47
CYP2A6 P11509 1/20 0.47
CYP17A1 P05093 1/20 0.46
CYP21A2 P08686 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.43
MEN1 O00255 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 1/20 0.42
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
ENPP2 Q13822 1/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 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
SCHEMBL2570787 0.81 IDO1 (0.63) IDO1CYP3A4CYP11B1CYP11B2CYP19A1
SCHEMBL29546575 0.81 IDO1 (0.63) IDO1CYP3A4CYP11B1CYP11B2CYP19A1
SCHEMBL8588678 0.81 IDO1 (0.51) IDO1CYP3A4CYP11B1CYP11B2CYP19A1
SCHEMBL8588675 0.81 IDO1 (0.51) IDO1CYP3A4CYP11B1CYP11B2CYP19A1
SCHEMBL7295758 0.80 MAPT (0.55) CYP3A4CYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL6847884 0.80 MAPT (0.55) CYP3A4CYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL14489499 0.79 IDO1 (0.75) IDO1CYP3A4CYP11B1CYP11B2CYP19A1
SCHEMBL9454360 0.79 IDO1 (0.52) IDO1CYP3A4CYP11B1CYP11B2CYP19A1
SCHEMBL9454350 0.79 IDO1 (0.52) IDO1CYP3A4CYP11B1CYP11B2CYP19A1
SCHEMBL8828227 0.76 IDO1 (0.50) IDO1CYP3A4CYP11B1CYP11B2CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7365174-B2 Azalide and azalactam derivatives and method for producing the same MEIJI SEIKA KAISHA, LTD. (JP) 2008-04-29 US claimed
US-20070042974-A1 Nozel azalide and azalactam derivatives and method for producing the same MEIJI SEIKA KAISHA, LTD. (JP) 2007-02-22 US claimed
EP-1661904-A1 NOVEL AZALIDE AND AZALACTAM DERIVATIVES AND PROCESS FOR THE PRODUCTION OF THE SAME MEIJI SEIKA KAISHA LTD. (JP) 2006-05-31 EP claimed
US-7365174-B2 Azalide and azalactam derivatives and method for producing the same MEIJI SEIKA KAISHA, LTD. (JP) 2008-04-29 US disclosed
US-20070042974-A1 Nozel azalide and azalactam derivatives and method for producing the same MEIJI SEIKA KAISHA, LTD. (JP) 2007-02-22 US disclosed
EP-1661904-A1 NOVEL AZALIDE AND AZALACTAM DERIVATIVES AND PROCESS FOR THE PRODUCTION OF THE SAME MEIJI SEIKA KAISHA LTD. (JP) 2006-05-31 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-20070042974-A1 Nozel azalide and azalactam derivatives and method for producing the same BCL6, NR4A1, NR4A2 IDO1 2635/4885CYP3A4 297/4885CYP11B1 402/4885

“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.