SCHEMBL12166452

SCHEMBL12166452

c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)nc(-c4ccc5c(c4)C(c4cc(-c6ccccc6)cc(-c6ccccc6)c4)(c4cc(-c6ccccc6)cc(-c6ccccc6)c4)c4ccccc4-5)n3)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 14/20 0.41
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
MAPT P10636 4/20 0.39
KDM4E B2RXH2 3/20 0.39
LMNA P02545 3/20 0.39
OPRK1 P41145 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 3/20 0.37
HPGD P15428 3/20 0.37
NTSR1 P30989 1/20 0.34
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
GLA P06280 1/20 0.33

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
SCHEMBL12166479 1.00 PDK2 (0.41) PDK2MEN1KMT2AMAPTKDM4E
SCHEMBL12166469 0.97 PDK2 (0.43) PDK2MEN1KMT2AMAPTKDM4E
SCHEMBL12166456 0.97 PDK2 (0.43) PDK2MEN1KMT2AMAPTKDM4E
SCHEMBL12166472 0.97 PDK2 (0.43) PDK2MEN1KMT2AMAPTKDM4E
SCHEMBL12166487 0.97 PDK2 (0.43) PDK2MEN1KMT2AMAPTKDM4E
SCHEMBL12166454 0.97 PDK2 (0.41) PDK2MEN1KMT2AMAPTKDM4E
SCHEMBL12166477 0.97 PDK2 (0.41) PDK2MEN1KMT2AMAPTKDM4E
SCHEMBL12166496 0.96 PDK2 (0.42) PDK2MEN1KMT2AMAPTKDM4E
SCHEMBL12166468 0.96 PDK2 (0.43) PDK2MEN1KMT2AMAPTKDM4E
SCHEMBL12166455 0.96 PDK2 (0.43) PDK2MEN1KMT2AMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11760734-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2023-09-19 US disclosed
US-11760734-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2023-09-19 US disclosed
US-20210221775-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-07-22 US disclosed
US-10981880-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2021-04-20 US disclosed
US-20190169139-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-06-06 US disclosed
US-10233159-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2019-03-19 US disclosed
US-20160096809-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2016-04-07 US disclosed
US-9187456-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-11-17 US disclosed
US-20120228554-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-09-13 US disclosed
US-20120228554-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-09-13 US disclosed
WO-2011060859-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2011-05-26 WO 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 (7 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-10233159-B2 Materials for organic electroluminescent devices SLCO4C1, SLCO2B1, SLCO2A1 PDK2 2688/4885MEN1 665/4885KMT2A 2454/4885
US-20190169139-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO4C1, SLCO2B1, SLCO2A1 PDK2 2688/4885MEN1 665/4885KMT2A 2454/4885
US-20210221775-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO4C1, SLCO2B1, SLCO2A1 PDK2 2688/4885MEN1 665/4885KMT2A 2454/4885
US-10981880-B2 Materials for organic electroluminescent devices SLCO4C1, SLCO2B1, SLCO2A1 PDK2 2688/4885MEN1 665/4885KMT2A 2454/4885
US-20120228554-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO4C1, SLCO2B1, SLCO2A1 PDK2 2688/4885MEN1 665/4885KMT2A 2454/4885
US-20160096809-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO4C1, SLCO2B1, SLCO2A1 PDK2 2688/4885MEN1 665/4885KMT2A 2454/4885
US-11760734-B2 Materials for organic electroluminescent devices SLCO4C1, SLCO2B1, SLCO2A1 PDK2 2688/4885MEN1 665/4885KMT2A 2454/4885

“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.