SCHEMBL21660757

SCHEMBL21660757

c1ccc(-c2cc(-c3ccccc3)c3c(c2)cc2c4ccccc4nc-2n3-c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HSP90AA1 P07900 1/20 0.41
ESR1 P03372 2/20 0.40
ESR2 Q92731 2/20 0.40
KDM4E B2RXH2 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ATM Q13315 1/20 0.40
ALDH1A1 P00352 6/20 0.38
HPGD P15428 2/20 0.38
MAPK1 P28482 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
ACACA Q13085 2/20 0.36
RECQL P46063 1/20 0.36
RAB9A P51151 2/20 0.35
GRIA1 P42261 1/20 0.35
CACNG8 Q8WXS5 1/20 0.35
CACNG2 Q9Y698 1/20 0.35
HDAC4 P56524 1/20 0.35

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
SCHEMBL21660554 0.84 KDM4E (0.45) MAPTMEN1KMT2AHSP90AA1ESR1
SCHEMBL11921452 0.81 L3MBTL1 (0.50) MAPTMEN1KMT2AHSP90AA1ESR1
SCHEMBL21660666 0.81 ALDH1A1 (0.37) MAPTMEN1KMT2AHSP90AA1ESR1
SCHEMBL17177814 0.80 ESR1 (0.56) MAPTMEN1KMT2AHSP90AA1ESR1
SCHEMBL22666378 0.79 L3MBTL1 (0.47) MAPTMEN1KMT2AHSP90AA1ESR1
SCHEMBL17177859 0.79 L3MBTL1 (0.47) MAPTMEN1KMT2AHSP90AA1ESR1
SCHEMBL17177911 0.79 L3MBTL1 (0.52) MAPTMEN1KMT2AESR1ESR2
SCHEMBL22666379 0.79 L3MBTL1 (0.47) MAPTMEN1KMT2AHSP90AA1ESR1
SCHEMBL17885118 0.79 L3MBTL1 (0.47) MAPTMEN1KMT2AHSP90AA1ESR1
SCHEMBL21660629 0.79 PTGER4 (0.43) MAPTMEN1KMT2AHSP90AA1ESR1

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
EP-3583104-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-06-09 EP disclosed
US-10923665-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2021-02-16 US disclosed
US-20200044162-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-02-06 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-10923665-B2 Materials for organic electroluminescent devices OR10J3, L1CAM, EPCAM MAPT 753/4885MEN1 2049/4885KMT2A 1679/4885
US-20200044162-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES OR10J3, L1CAM, EPCAM MAPT 753/4885MEN1 2049/4885KMT2A 1679/4885

“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.