SCHEMBL22011687

SCHEMBL22011687

c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4c5oc6ccccc6c5c5c(ccc6sc7ccccc7c65)c43)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.33
TSHR P16473 3/20 0.33
LMNA P02545 4/20 0.31
KDM4E B2RXH2 3/20 0.31
HSD17B10 Q99714 2/20 0.31
MAPK1 P28482 1/20 0.31
ALDH1A1 P00352 4/20 0.31
POLB P06746 2/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
USP2 O75604 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL22011552 0.92 ESR2 (0.30)
SCHEMBL17405566 0.87 MAPT (0.34) MAPTTSHRLMNAKDM4EHSD17B10
SCHEMBL22011563 0.87 MAPT (0.36) MAPTTSHRLMNAKDM4EHSD17B10
SCHEMBL17405904 0.86 MAPT (0.35) MAPTTSHRLMNAKDM4EHSD17B10
SCHEMBL16275479 0.85 MAPT (0.34) MAPTTSHRLMNAKDM4EHSD17B10
SCHEMBL16275630 0.85 MAPT (0.34) MAPTTSHRLMNAKDM4EHSD17B10
SCHEMBL24172229 0.85
SCHEMBL22011556 0.85
SCHEMBL18687911 0.85
SCHEMBL22011555 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12035625-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2024-07-09 US disclosed
US-12035625-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2024-07-09 US disclosed
EP-3880682-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-06-14 EP disclosed
US-20220006030-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-01-06 US disclosed
WO-2020099307-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-05-22 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 (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-20220006030-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES ZYX, RER1, AOC2 MAPT 4261/4885TSHR 3272/4885LMNA 1050/4885
US-12035625-B2 Materials for organic electroluminescent devices ZYX, RER1, AOC2 MAPT 4261/4885TSHR 3272/4885LMNA 1050/4885

“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.