SCHEMBL20009901

SCHEMBL20009901

c1ccc(-n2c(-c3ccc(-c4cc(-c5c6ccccc6c(-c6ccc7ccccc7c6)c6ccccc56)cc5ccccc45)cc3)nc3ccccc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46
GRIA1 P42261 1/20 0.43
CACNG8 Q8WXS5 1/20 0.43
CACNG2 Q9Y698 1/20 0.43
MAPK10 P53779 3/20 0.42
RECQL P46063 1/20 0.41
SIRT2 Q8IXJ6 1/20 0.41
SIRT1 Q96EB6 1/20 0.41
PTGER4 P35408 1/20 0.40
HTT P42858 2/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 6/20 0.40
RAB9A P51151 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
PTGS2 P35354 1/20 0.39
MEN1 O00255 1/20 0.39
HSP90AA1 P07900 1/20 0.39

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
SCHEMBL13098744 0.91 ESR1 (0.52) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL134057 0.91 ESR1 (0.52) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL29444817 0.91 ESR1 (0.52) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL24811898 0.90 ESR1 (0.51) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL24812242 0.90 ESR1 (0.50) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL21698517 0.89 ESR1 (0.44) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL14363372 0.88 SIRT2 (0.41) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL24811900 0.87 RECQL (0.49) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL12571628 0.87 ESR1 (0.49) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL17452050 0.87 ESR1 (0.43) ESR1ESR2GRIA1CACNG8CACNG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10573824-B2 Compound and organic electronic element comprising same LG CHEM, LTD. (KR) 2020-02-25 US disclosed
US-20180090688-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-29 US disclosed
US-20180090688-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-29 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 (2 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-20180090688-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME OR10J3, ETV6, BMI1 ESR1 4/4885ESR2 32/4885GRIA1 1472/4885
US-10573824-B2 Compound and organic electronic element comprising same OR10J3, ETV6, BMI1 ESR1 4/4885ESR2 32/4885GRIA1 1472/4885

“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.