SCHEMBL21264446

SCHEMBL21264446

c1ccc2c(c1)-c1ccccc1C21c2cc3c(cc2-c2cc4c5c6ccccc6ccc5n(-c5cccc6c5oc5ccccc56)c4cc21)c1c2ccccc2ccc1n3-c1cccc2c1oc1ccccc12

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.33
GGPS1 O95749 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
PRKDC P78527 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
SCHEMBL22617748 0.88
SCHEMBL20633785 0.87 ALOX5 (0.33) ALOX5GGPS1PRKDC
SCHEMBL20199620 0.86 POLB (0.35) TDP1
SCHEMBL21290386 0.86
SCHEMBL24380055 0.85 ALOX5 (0.31) ALOX5
SCHEMBL15946290 0.85 ALOX5 (0.36) ALOX5GGPS1PRKDC
SCHEMBL21397919 0.83 TDP1 (0.33) TDP1L3MBTL1
SCHEMBL20199638 0.82 SIRT2 (0.34) TDP1L3MBTL1
SCHEMBL20199751 0.82 POLB (0.35) TDP1
SCHEMBL14822423 0.82 ALOX5 (0.34) ALOX5GGPS1PRKDC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11917903-B2 Metal complexes UDC IRELAND LIMITED (IE) 2024-02-27 US disclosed
US-11917903-B2 Metal complexes UDC IRELAND LIMITED (IE) 2024-02-27 US disclosed
US-20230320191-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2023-10-05 US disclosed
US-11659763-B2 Metal complexes MERCK PATENT GMBH 2023-05-23 US disclosed
US-11535640-B2 Metal complexes MERCK PATENT GMBH (DE) 2022-12-27 US disclosed
US-11322696-B2 Metal complexes MERCK PATENT GMBH (DE) 2022-05-03 US disclosed
US-11145828-B2 Metal complexes MERCK PATENT GMBH (DE) 2021-10-12 US disclosed
US-11136343-B2 Binuclear metal complexes for use as emitters in organic electroluminescent devices MERCK PATENT GMBH (DE) 2021-10-05 US disclosed
US-20210175441-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2021-06-10 US disclosed
US-20210111345-A1 METAL COMPLEXES UDC IRELAND LIMITED (IE) 2021-04-15 US disclosed
US-20200207794-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2020-07-02 US disclosed
US-20200052213-A1 BINUCLEAR METAL COMPLEXES AND ELECTRONIC DEVICES, IN PARTICULAR ORGANIC ELECTROLUMINESCENT DEVICES CONTAINING SAID METAL COMPLEXES MERCK PATENT GMBH (DE) 2020-02-13 US disclosed
US-20190252628-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2019-08-15 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 (12 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-11145828-B2 Metal complexes AP1M1, AP2M1, AP3M1 ALOX5 3754/4885GGPS1 2747/4885TDP1 3796/4885
US-20190252628-A1 METAL COMPLEXES AP1M1, AP2M1, AP3M1 ALOX5 3754/4885GGPS1 2747/4885TDP1 3796/4885
US-20230320191-A1 METAL COMPLEXES IMMT, MCU, SOD1 ALOX5 3289/4885GGPS1 1855/4885TDP1 2399/4885
US-20210111345-A1 METAL COMPLEXES NCLN, BICRA, AP3M1 ALOX5 4255/4885GGPS1 3541/4885TDP1 3251/4885
US-20210175441-A1 METAL COMPLEXES IMMT, MCU, SOD1 ALOX5 3289/4885GGPS1 1855/4885TDP1 2399/4885
US-20200207794-A1 METAL COMPLEXES IMMT, MCU, SOD1 ALOX5 3289/4885GGPS1 1855/4885TDP1 2399/4885
US-11322696-B2 Metal complexes AP1M1, AP3M1, AP2M1 ALOX5 3642/4885GGPS1 2261/4885TDP1 3219/4885
US-11535640-B2 Metal complexes IMMT, MCU, SOD1 ALOX5 3289/4885GGPS1 1855/4885TDP1 2399/4885
US-11659763-B2 Metal complexes IMMT, MCU, SOD1 ALOX5 3289/4885GGPS1 1855/4885TDP1 2399/4885
US-11136343-B2 Binuclear metal complexes for use as emitters in organic electroluminescent devices AP2M1, MCU, AP3M1 ALOX5 3839/4885GGPS1 1731/4885TDP1 2620/4885
US-20200052213-A1 BINUCLEAR METAL COMPLEXES AND ELECTRONIC DEVICES, IN PARTICULAR ORGANIC ELECTROLUMINESCENT DEVICES CONTAINING SAID METAL COMPLEXES BICRA, NCLN, IMMT ALOX5 3622/4885GGPS1 2840/4885TDP1 3999/4885
US-11917903-B2 Metal complexes NCLN, BICRA, AP3M1 ALOX5 4255/4885GGPS1 3541/4885TDP1 3251/4885

“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.