SCHEMBL5072166

SCHEMBL5072166

COC(=O)c1ccccc1-c1ccc(-c2ccccc2C(=O)OC)c2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 5/20 0.59
SLC6A4 P31645 3/20 0.59
TSHR P16473 2/20 0.57
LMNA P02545 1/20 0.57
SLC6A2 P23975 1/20 0.56
ALDH1A1 P00352 2/20 0.55
CFTR P13569 1/20 0.55
HSD17B10 Q99714 1/20 0.55
KDM4E B2RXH2 2/20 0.53
POLB P06746 1/20 0.53
ATM Q13315 1/20 0.53
NR4A2 P43354 2/20 0.51
CREBBP Q92793 1/20 0.51
MAPT P10636 3/20 0.50
KMT2A Q03164 2/20 0.50
MITF O75030 1/20 0.50
MEN1 O00255 1/20 0.50
HTT P42858 1/20 0.50
MAPK10 P53779 1/20 0.50
PTK2B Q14289 1/20 0.50

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
SCHEMBL18539206 0.96 SLC6A3 (0.59) SLC6A3SLC6A4TSHRLMNASLC6A2
SCHEMBL69464 0.92 SLC6A3 (0.67) SLC6A3SLC6A4TSHRLMNASLC6A2
SCHEMBL13324417 0.90 SLC6A3 (0.50) SLC6A3SLC6A4TSHRLMNASLC6A2
SCHEMBL18352308 0.90 PLK1 (0.54) SLC6A3SLC6A4TSHRLMNASLC6A2
SCHEMBL18302011 0.90 SLC6A3 (0.56) SLC6A3SLC6A4TSHRLMNASLC6A2
SCHEMBL10010690 0.89 SLC6A3 (0.58) SLC6A3SLC6A4TSHRLMNASLC6A2
SCHEMBL12724753 0.86 SLC6A3 (0.57) SLC6A3SLC6A4TSHRLMNASLC6A2
SCHEMBL27472310 0.86 SLC6A3 (0.62) SLC6A3SLC6A4TSHRLMNASLC6A2
SCHEMBL25523280 0.86 SLC6A3 (0.56) SLC6A3SLC6A4TSHRLMNASLC6A2
SCHEMBL28899477 0.85 SLC6A3 (0.57) SLC6A3SLC6A4TSHRLMNASLC6A2

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
EP-3211058-B1 NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-08-23 EP disclosed
EP-3211058-B1 NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-08-23 EP disclosed
EP-3211058-A1 NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2017-08-30 EP disclosed
EP-3211058-A1 NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2017-08-30 EP disclosed
US-8748010-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2014-06-10 US disclosed
US-8748010-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2014-06-10 US disclosed
US-8748010-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2014-06-10 US disclosed
US-20080193797-A1 Novel Materials for Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-08-14 US disclosed
US-20080193797-A1 Novel Materials for Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-08-14 US disclosed
US-20080193797-A1 Novel Materials for Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-08-14 US disclosed
WO-2007022845-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2007-03-01 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 (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-20080193797-A1 Novel Materials for Organic Electroluminescent Devices SLC40A1, SLC67A1, SLC29A1 SLC6A3 352/4885SLC6A4 623/4885TSHR 4648/4885

“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.