SCHEMBL22011951

SCHEMBL22011951

CC1(C)c2ccccc2-c2ccc3c(sc4ccc5ccc6sc7ccccc7c6c5c43)c21

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
DUSP3 P51452 1/20 0.33
BLM P54132 1/20 0.33
PTPN5 P54829 1/20 0.33
KMT2A Q03164 1/20 0.33
PTPN11 Q06124 1/20 0.33
MCL1 Q07820 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PARP14 Q460N5 1/20 0.31
GPR3 P46089 1/20 0.31
ALOX5 P09917 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
SCHEMBL17694784 0.84 PARP14 (0.42) MEN1MAPTKMT2APARP14GPR3
SCHEMBL24557138 0.84 MAPT (0.38) MEN1POLBMAPTDUSP3BLM
SCHEMBL17299430 0.84 PARP14 (0.38) MAPTPARP14GPR3ALOX5
SCHEMBL22011943 0.83 MAPT (0.34) MEN1POLBMAPTDUSP3BLM
SCHEMBL19108392 0.83 MAPT (0.36) MEN1POLBMAPTDUSP3BLM
SCHEMBL22011416 0.81 MAPT (0.36) MEN1POLBMAPTDUSP3BLM
SCHEMBL22011696 0.81 MAPT (0.36) MEN1POLBMAPTDUSP3BLM
SCHEMBL22011702 0.79 MAPT (0.34) MEN1POLBMAPTDUSP3BLM
SCHEMBL22011413 0.79 MAPT (0.34) MEN1POLBMAPTDUSP3BLM
SCHEMBL19109677 0.79 MEN1 (0.31) MEN1POLBMAPTDUSP3BLM

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 MEN1 1681/4885POLB 4117/4885MAPT 4261/4885
US-12035625-B2 Materials for organic electroluminescent devices ZYX, RER1, AOC2 MEN1 1681/4885POLB 4117/4885MAPT 4261/4885

“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.