SCHEMBL17816640

SCHEMBL17816640

Brc1cccc(C2(c3ccccc3)c3ccccc3-c3ccccc3-c3ccccc32)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
LMNA P02545 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
OPRK1 P41145 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
NPSR1 Q6W5P4 1/20 0.41
PDK2 Q15119 1/20 0.39
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
POLB P06746 1/20 0.37
PTPRC P08575 1/20 0.35
S100A4 P26447 1/20 0.35
TDP1 Q9NUW8 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HSP90AA1 P07900 1/20 0.34
CFTR P13569 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
SCHEMBL29740923 0.98 MEN1 (0.48) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL30726502 0.98 MEN1 (0.48) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL283740 0.98 MEN1 (0.48) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL1495151 0.94 ESR1 (0.47) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL30153131 0.94 ESR1 (0.47) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL31678349 0.93 ESR1 (0.46) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL19735694 0.92 LMNA (0.43) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL19735693 0.92 LMNA (0.43) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL21764711 0.89 ESR1 (0.49) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL1645301 0.88 SMN1; SMN2 (0.43) MEN1KMT2ALMNAKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3227269-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-02-26 EP disclosed
US-10573818-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2020-02-25 US disclosed
US-20170324037-A1 POLYCYCLIC COMPOUND AND ORGANIC ELETROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-11-09 US disclosed
US-20170324037-A1 POLYCYCLIC COMPOUND AND ORGANIC ELETROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-11-09 US disclosed
US-20170317283-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-11-02 US disclosed
US-20170317283-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-11-02 US disclosed
WO-2016087017-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2016-06-09 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 (3 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-20170324037-A1 POLYCYCLIC COMPOUND AND ORGANIC ELETROLUMINESCENCE DEVICE INCLUDING THE SAME AR, ARL1, ESR2 MEN1 760/4885KMT2A 666/4885LMNA 1525/4885
US-20170317283-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES PIEZO1, LEF1, EFNA1 MEN1 472/4885KMT2A 2805/4885LMNA 2221/4885
US-10573818-B2 Materials for organic electroluminescent devices PIEZO1, LEF1, EFNA1 MEN1 472/4885KMT2A 2805/4885LMNA 2221/4885

“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.