SCHEMBL22011579

SCHEMBL22011579

c1ccc(-n2c(-n3c4ccccc4c4c5oc6ccccc6c5c5c(ccc6oc7ccccc7c65)c43)nc3ccccc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.36
HTT P42858 2/20 0.36
PRKACA P17612 1/20 0.34
RPS6KB1 P23443 1/20 0.34
GSK3B P49841 1/20 0.34
ROCK1 Q13464 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
LMNA P02545 1/20 0.33
KDM4E B2RXH2 2/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 2/20 0.32
PPARG P37231 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
NR2E3 Q9Y5X4 1/20 0.32
NCOR2 Q9Y618 1/20 0.32
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
GSR P00390 1/20 0.32
NPC1 O15118 1/20 0.32

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
SCHEMBL24171792 0.93 MAPK1 (0.36) MAPK1HTTPRKACARPS6KB1GSK3B
SCHEMBL17246212 0.89 MAPK1 (0.39) MAPK1HTTPRKACARPS6KB1GSK3B
SCHEMBL22011531 0.88 KDM4E (0.40) MAPK1HTTSMN1; SMN2LMNAKDM4E
SCHEMBL17246109 0.87 MAPK1 (0.43) MAPK1HTTPRKACARPS6KB1GSK3B
SCHEMBL17246210 0.84 MAPK1 (0.40) MAPK1HTTPRKACARPS6KB1GSK3B
SCHEMBL17246108 0.83 MAPK1 (0.41) MAPK1HTTPRKACARPS6KB1GSK3B
SCHEMBL19287647 0.81 MAPK1 (0.32) MAPK1HTTPRKACARPS6KB1GSK3B
SCHEMBL17705464 0.81 MAPK1 (0.43) MAPK1HTTPRKACARPS6KB1GSK3B
SCHEMBL22011581 0.80 HSD17B10 (0.36) HTTKDM4EALDH1A1RXFP1NPC1
SCHEMBL22013002 0.80 GLA (0.33) KDM4EL3MBTL1ALDH1A1NPC1RAB9A

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 MAPK1 560/4885HTT 4421/4885PRKACA 3911/4885
US-12035625-B2 Materials for organic electroluminescent devices ZYX, RER1, AOC2 MAPK1 560/4885HTT 4421/4885PRKACA 3911/4885

“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.