SCHEMBL10028152

SCHEMBL10028152

c1ccc2c(c1)c1ccccc1n2-c1ccc2cc3oc4ccc5c6cc(-n7c8ccccc8c8ccccc87)ccc6cc6oc7ccc(c2c1)c3c7-c4c65

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
AHR P35869 2/20 0.31
ERBB2 P04626 1/20 0.31
CYP1A2 P05177 1/20 0.31
FYN P06241 1/20 0.31
MAOA P21397 1/20 0.31
ACHE P22303 1/20 0.31

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
SCHEMBL14301627 0.87 EDNRB (0.30)
SCHEMBL10028101 0.81 KDM4E (0.43) KDM4EATML3MBTL1AHRCYP1A2
SCHEMBL16743109 0.81 KDM4E (0.46) KDM4EATML3MBTL1AHRMAOA
SCHEMBL25602238 0.79 KDM4E (0.43) KDM4EATML3MBTL1AHRMAOA
SCHEMBL13507684 0.78 KDM4E (0.46) KDM4EATML3MBTL1AHRCYP1A2
SCHEMBL9890528 0.78 KDM4E (0.48) KDM4EATML3MBTL1AHRCYP1A2
SCHEMBL29551183 0.77 KDM4E (0.52) KDM4EATML3MBTL1AHRCYP1A2
SCHEMBL5028280 0.77 KDM4E (0.52) KDM4EATML3MBTL1AHRCYP1A2
SCHEMBL10028239 0.77 AHR (0.46) KDM4EL3MBTL1AHRERBB2CYP1A2
SCHEMBL26286318 0.77 KDM4E (0.44) KDM4EATML3MBTL1AHRCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046915-B1 NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-12-02 EP disclosed
US-8114531-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2012-02-14 US disclosed
US-8114531-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2012-02-14 US disclosed
US-20100013381-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-01-21 US disclosed
US-20100013381-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-01-21 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-20100013381-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, SOD1, SLC40A1 KDM4E 2432/4885ATM 4219/4885L3MBTL1 2470/4885

“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.