SCHEMBL16634843

SCHEMBL16634843

c1ccc(-c2nc3ccccc3n2-c2cccc3c2oc2ccccc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.46
ESR2 Q92731 1/20 0.46
ALDH1A1 P00352 3/20 0.45
KDM4E B2RXH2 3/20 0.45
HPGD P15428 2/20 0.45
POLB P06746 1/20 0.44
PDE6D O43924 1/20 0.42
ALDH2 P05091 1/20 0.42
ALDH3A1 P30838 1/20 0.42
PTGS2 P35354 1/20 0.39
KMT2A Q03164 5/20 0.39
MEN1 O00255 4/20 0.39
MAPT P10636 3/20 0.39
GAA P10253 1/20 0.39
TP53 P04637 1/20 0.39
CSF1R P07333 1/20 0.38
PDGFRB P09619 1/20 0.38
KIT P10721 1/20 0.38
FLT3 P36888 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38

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
SCHEMBL12349671 0.88 ALOX5 (0.43) ESR1ESR2ALDH1A1KDM4EHPGD
SCHEMBL15393859 0.88 ESR1 (0.44) ESR1ESR2ALDH1A1KDM4EHPGD
SCHEMBL22177882 0.84 ESR1 (0.39) ESR1ESR2ALDH1A1KDM4EHPGD
SCHEMBL12349386 0.83 GSR (0.43) ESR1ESR2ALDH1A1KDM4EHPGD
SCHEMBL15316028 0.83 ESR1 (0.39) ESR1ESR2ALDH1A1KDM4EHPGD
SCHEMBL15394379 0.83 ESR1 (0.42) ESR1ESR2ALDH1A1KDM4EHPGD
SCHEMBL15393834 0.83 ESR1 (0.40) ESR1ESR2ALDH1A1KDM4EHPGD
SCHEMBL16442513 0.82 ESR1 (0.47) ESR1ESR2ALDH1A1KDM4EHPGD
SCHEMBL15394084 0.82 ESR1 (0.46) ESR1ESR2ALDH1A1KDM4EHPGD
SCHEMBL21883328 0.82 ESR1 (0.43) ESR1ESR2ALDH1A1KDM4EHPGD

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
US-12336428-B2 Materials for electronic devices MERCK PATENT GMBH (DE) 2025-06-17 US disclosed
US-20240130231-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2024-04-18 US disclosed
US-11856849-B2 Materials for electronic devices MERCK PATENT GMBH (DE) 2023-12-26 US disclosed
EP-3055303-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-12-02 EP disclosed
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
US-20160248023-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2016-08-25 US disclosed
EP-3055303-A1 MATERIALS FOR ELECTRONIC DEVICES Merck Patent GmbH (DE) 2016-08-17 EP disclosed
WO-2015051869-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2015-04-16 WO 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 (4 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 ESR1 18/4885ESR2 99/4885ALDH1A1 185/4885
US-20240130231-A1 MATERIALS FOR ELECTRONIC DEVICES EPHA3, EPHA6, DDT ESR1 20/4885ESR2 76/4885ALDH1A1 1180/4885
US-12336428-B2 Materials for electronic devices EPHA3, EPHA6, DDT ESR1 20/4885ESR2 76/4885ALDH1A1 1180/4885
US-11856849-B2 Materials for electronic devices EFNA1, LEF1, KCNC1 ESR1 18/4885ESR2 99/4885ALDH1A1 185/4885

“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.