SCHEMBL20927640

SCHEMBL20927640

CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(Cl)ccc3-4)cc21

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 11/20 0.51
AKR1A1 P14550 1/20 0.44
AKR1B1 P15121 1/20 0.44
PGR P06401 5/20 0.43

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
SCHEMBL24969748 0.93 PDK2 (0.50) PDK2AKR1A1AKR1B1PGR
SCHEMBL12362762 0.93 PDK2 (0.59) PDK2PGR
SCHEMBL30865781 0.93 PDK2 (0.59) PDK2PGR
SCHEMBL24665388 0.93 PDK2 (0.59) PDK2PGR
SCHEMBL1922761 0.93 PDK2 (0.54) PDK2AKR1A1AKR1B1PGR
SCHEMBL29402770 0.93 PDK2 (0.54) PDK2AKR1A1AKR1B1PGR
SCHEMBL22956787 0.91 PDK2 (0.53) PDK2AKR1A1AKR1B1PGR
SCHEMBL17326962 0.90 PDK2 (0.61) PDK2PGR
SCHEMBL23951447 0.90 PGR (0.50) PDK2PGR
SCHEMBL1649136 0.89 PDK2 (0.47) PDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11639339-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2023-05-02 US disclosed
US-11639339-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2023-05-02 US disclosed
US-11578063-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2023-02-14 US disclosed
US-11365167-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2022-06-21 US disclosed
EP-3792235-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2021-03-17 EP disclosed
US-20210053894-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-02-25 US disclosed
EP-3481796-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-02-17 EP disclosed
US-20210024481-A1 MATERIALS FOR ORGANIC ELETROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-01-28 US disclosed
US-20210005821-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-01-07 US disclosed
US-20200369678-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-11-26 US disclosed
US-20200277284-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-09-03 US disclosed
US-20200144505-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2020-05-07 US disclosed
WO-2019170572-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-09-12 WO disclosed
WO-2019101835-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-05-31 WO disclosed
WO-2019076789-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-04-25 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 (8 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-20210024481-A1 MATERIALS FOR ORGANIC ELETROLUMINESCENT DEVICES GLB1, EFNA1, L1CAM PDK2 2270/4885AKR1A1 2169/4885AKR1B1 1755/4885
US-11639339-B2 Materials for organic electroluminescent devices L1CAM, EFNA1, EPCAM PDK2 1024/4885AKR1A1 1867/4885AKR1B1 1760/4885
US-20200277284-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, EFNA1, EPCAM PDK2 1024/4885AKR1A1 1867/4885AKR1B1 1760/4885
US-20210053894-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, EFNA1, EPCAM PDK2 1024/4885AKR1A1 1867/4885AKR1B1 1760/4885
US-11578063-B2 Materials for organic electroluminescent devices GPX1, EPCAM, EFNA1 PDK2 965/4885AKR1A1 1562/4885AKR1B1 1557/4885
US-20210005821-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, EFNA1, EPCAM PDK2 1024/4885AKR1A1 1867/4885AKR1B1 1760/4885
US-11365167-B2 Materials for organic electroluminescent devices L1CAM, EFNA1, EPCAM PDK2 1024/4885AKR1A1 1867/4885AKR1B1 1760/4885
US-20200369678-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, EFNA1, EPCAM PDK2 1024/4885AKR1A1 1867/4885AKR1B1 1760/4885

“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.