SCHEMBL19194342

SCHEMBL19194342

c1ccc(-c2nc3ccccc3n2-c2cccc(-c3nc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)nc(-c4cccc5oc6ccccc6c45)n3)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
GAA P10253 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HDAC1 Q13547 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
RECQL P46063 1/20 0.33
ALDH1A1 P00352 3/20 0.32
LMNA P02545 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
RPS6KB1 P23443 3/20 0.31
PRKACA P17612 1/20 0.31
GSK3B P49841 1/20 0.31
ROCK1 Q13464 1/20 0.31
GRIA1 P42261 1/20 0.31

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
SCHEMBL19193753 0.92 ESR1 (0.35) ESR1ESR2GAAMEN1KMT2A
SCHEMBL17470568 0.90 ESR1 (0.44) ESR1ESR2GAAMEN1KMT2A
SCHEMBL19193631 0.90 ESR1 (0.34) ESR1ESR2GAAMEN1KMT2A
SCHEMBL17470610 0.88 HDAC1 (0.34) ESR1ESR2GAAMEN1KMT2A
SCHEMBL19193791 0.88 ESR1 (0.44) ESR1ESR2GAAMEN1KMT2A
SCHEMBL19193828 0.87 ESR1 (0.41) ESR1ESR2GAAMEN1KMT2A
SCHEMBL17470564 0.86 HDAC1 (0.36) ESR1ESR2GAAMEN1KMT2A
SCHEMBL22177346 0.85 HDAC1 (0.35) ESR1ESR2HDAC1HDAC8HDAC6
SCHEMBL22177510 0.85 HDAC1 (0.35) ESR1ESR2HDAC1HDAC8HDAC6
SCHEMBL20465554 0.85 HDAC1 (0.35) ESR1ESR2GAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170222157-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-08-03 US disclosed
US-20170222157-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-08-03 US 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-20170222157-A1 MATERIALS FOR ELECTRONIC DEVICES EYA3, EYA2, MITF ESR1 12/4885ESR2 90/4885GAA 3195/4885

“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.