SCHEMBL21702890

SCHEMBL21702890

c1ccc(-c2cc(-c3ccc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)cc3)c3ccc4ccccc4c3c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.51
ESR2 Q92731 1/20 0.51
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
HSP90AA1 P07900 1/20 0.45
MAPT P10636 1/20 0.45
GRIA1 P42261 1/20 0.44
CACNG8 Q8WXS5 1/20 0.44
CACNG2 Q9Y698 1/20 0.44
RECQL P46063 1/20 0.43
HTT P42858 2/20 0.42
MAPK1 P28482 1/20 0.42
PTGER4 P35408 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
ALDH1A1 P00352 7/20 0.41
HPGD P15428 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 2/20 0.41

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
SCHEMBL10019145 0.92 ESR1 (0.51) ESR1ESR2KMT2AMEN1HSP90AA1
SCHEMBL28969824 0.91 ESR1 (0.51) ESR1ESR2KMT2AMEN1HSP90AA1
SCHEMBL12912432 0.91 ESR1 (0.56) ESR1ESR2KMT2AMEN1HSP90AA1
SCHEMBL19628222 0.89 ESR1 (0.54) ESR1ESR2KMT2AMEN1HSP90AA1
SCHEMBL19628215 0.89 ESR1 (0.54) ESR1ESR2KMT2AMEN1HSP90AA1
SCHEMBL23759389 0.88 ESR1 (0.52) ESR1ESR2KMT2AMEN1HSP90AA1
SCHEMBL19628212 0.87 ESR1 (0.54) ESR1ESR2KMT2AMEN1HSP90AA1
SCHEMBL19871618 0.87 ESR1 (0.53) ESR1ESR2KMT2AMEN1HSP90AA1
SCHEMBL10019150 0.86 ESR1 (0.56) ESR1ESR2KMT2AMEN1HSP90AA1
SCHEMBL26825359 0.86 ESR1 (0.50) ESR1ESR2KMT2AMEN1HSP90AA1

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-11142538-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2021-10-12 US disclosed
US-20200048290-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2020-02-13 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-20200048290-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES ESRRG, ESR2, GLRA2 ESR1 38/4885ESR2 2/4885KMT2A 2244/4885
US-11142538-B2 Organic electroluminescent materials and devices ESRRG, ESR2, GLRA2 ESR1 38/4885ESR2 2/4885KMT2A 2244/4885

“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.