SCHEMBL16648183

SCHEMBL16648183

c1ccc(-c2ccc3c(c2)c2cc(-c4cccc5c4oc4c(-c6nc7ccccc7n6-c6ccccc6)cccc45)ccc2n3-c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.44
ESR1 P03372 3/20 0.41
ESR2 Q92731 3/20 0.41
PTGER4 P35408 1/20 0.41
RPS6KB1 P23443 2/20 0.38
PRKACA P17612 1/20 0.38
GSK3B P49841 1/20 0.38
ROCK1 Q13464 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HSP90AA1 P07900 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.36
GRIA1 P42261 1/20 0.36
CACNG8 Q8WXS5 1/20 0.36

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
SCHEMBL16442683 0.91 RECQL (0.42) RECQLESR1ESR2PTGER4RPS6KB1
SCHEMBL9290096 0.91 ESR1 (0.48) RECQLESR1ESR2PTGER4RPS6KB1
SCHEMBL16648182 0.90 ESR1 (0.41) RECQLESR1ESR2PTGER4RPS6KB1
SCHEMBL9288711 0.90 PTGER4 (0.46) RECQLESR1ESR2PTGER4RPS6KB1
SCHEMBL9288673 0.89 ESR1 (0.45) RECQLESR1ESR2PTGER4RPS6KB1
SCHEMBL9288680 0.88 PTGER4 (0.41) RECQLESR1ESR2PTGER4RPS6KB1
SCHEMBL21891300 0.88 PTGER4 (0.41) RECQLESR1ESR2PTGER4RPS6KB1
SCHEMBL9288668 0.87 ESR1 (0.43) RECQLESR1ESR2PTGER4RPS6KB1
SCHEMBL9290148 0.86 PTGER4 (0.41) RECQLESR1ESR2PTGER4RPS6KB1
SCHEMBL9288338 0.86 ESR1 (0.46) RECQLESR1ESR2PTGER4RPS6KB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3055303-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-12-02 EP disclosed
US-20160248023-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2016-08-25 US disclosed
US-20160248023-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2016-08-25 US disclosed
WO-2015051869-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2015-04-16 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-20160248023-A1 MATERIALS FOR ELECTRONIC DEVICES EFNA1, LEF1, KCNC1 RECQL 1804/4885ESR1 18/4885ESR2 99/4885

“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.