SCHEMBL4084808

SCHEMBL4084808

[C-]#[N+]c1ccc(N(c2ccc3cc(N(c4ccc(C#N)cc4-c4ccccc4)c4cccc5c4oc4ccccc45)c4cccc5ccc2c3c54)c2cccc3c2oc2ccccc23)c(-c2ccccc2)c1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.30

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
SCHEMBL4079279 0.97 PGR (0.32) PGR
SCHEMBL4186336 0.93 PGR (0.34) PGR
SCHEMBL4184051 0.89 PGR (0.36) PGR
SCHEMBL4089248 0.86
SCHEMBL26262608 0.83 PGR (0.35) PGR
SCHEMBL26286204 0.78
SCHEMBL10083946 0.77 TNKS (0.33) PGR
SCHEMBL26266694 0.77 PGR (0.33) PGR
SCHEMBL4083880 0.77 ALOX5 (0.38) PGR
SCHEMBL18798598 0.77 ALOX5 (0.38) PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431250-B2 Aromatic amine derivative, and organic electroluminescent element comprising the same IDEMITSU KOSAN CO., LTD. (JP) 2013-04-30 US disclosed
US-20120112169-A1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-05-10 US 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-20120112169-A1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME AR, H1-4, AFF4 PGR 1308/4885

“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.