SCHEMBL10028992

SCHEMBL10028992

c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4cc5ccc6cc(N(c7ccc8ccccc8c7)c7ccc8ccccc8c7)cc7ccc(c4)c5c67)cc3)c3ccccc23)cc1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
GSTP1 P09211 1/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
GPR84 Q9NQS5 1/20 0.31
ACMSD Q8TDX5 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
SCHEMBL10028997 1.00 RXRA (0.34) RXRARXRBGSTP1ESR1ESR2
SCHEMBL10029012 0.93 MAPK9 (0.38) RXRARXRB
SCHEMBL16271347 0.90 CYP1A2 (0.37) RXRARXRBGPR84ACMSD
SCHEMBL24154500 0.90 ESR1 (0.40) RXRARXRBGSTP1ESR1ESR2
SCHEMBL19660373 0.89 ESR1 (0.39) RXRARXRBGSTP1ESR1ESR2
SCHEMBL26374801 0.88 RXRA (0.39) RXRARXRBGSTP1ESR1ESR2
SCHEMBL13903631 0.88 RXRA (0.39) RXRARXRBGSTP1ESR1ESR2
SCHEMBL12128434 0.86 RELA (0.39) RXRARXRBGSTP1ESR1ESR2
SCHEMBL12019896 0.86 RXRA (0.36) RXRARXRBGSTP1ESR1ESR2
SCHEMBL12019775 0.86 RXRA (0.36) RXRARXRBGSTP1ESR1ESR2

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-8586211-B2 Asymmetrical aryl amine derivative for organic electroluminescence devices, method for preparing same, organic thin film for organic electroluminescence devices and organic electroluminescence device using same DONGWOO FINE-CHEM CO. LTD. (KR) 2013-11-19 US disclosed
US-20120032152-A1 Asymmetrical Aryl Amine Derivative for Organic Electroluminescence Devices, Method for Preparing Same, Organic Thin Film for Organic Electroluminescence Devices and Organic Electroluminescence Device Using Same DONGWOO FINE-CHEM CO. LTD. (KR) 2012-02-09 US disclosed
US-20120032152-A1 Asymmetrical Aryl Amine Derivative for Organic Electroluminescence Devices, Method for Preparing Same, Organic Thin Film for Organic Electroluminescence Devices and Organic Electroluminescence Device Using Same DONGWOO FINE-CHEM CO. LTD. (KR) 2012-02-09 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-20120032152-A1 Asymmetrical Aryl Amine Derivative for Organic Electroluminescence Devices, Method for Preparing Same, Organic Thin Film for Organic Electroluminescence Devices and Organic Electroluminescence Device Using Same AOC2, ALKBH2, ALKBH1 RXRA 3612/4885RXRB 3035/4885GSTP1 4604/4885

“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.