SCHEMBL21398051

SCHEMBL21398051

CCC1CC2CCCC(C2)c2ccc(-c3ccc(B4OC(C)(C)C(C)(C)O4)cn3)cc21

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.41
HIF1A Q16665 1/20 0.30
LPL P06858 1/20 0.30
LIPG Q9Y5X9 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
SCHEMBL19295082 0.82 DGAT1 (0.47) DGAT1LPLLIPG
SCHEMBL19794327 0.81 DGAT1 (0.47) DGAT1HIF1ALPLLIPG
SCHEMBL19933760 0.81 DGAT1 (0.47) DGAT1HIF1ALPLLIPG
SCHEMBL19794326 0.80 DGAT1 (0.49) DGAT1HIF1ALPLLIPG
SCHEMBL21125417 0.75 DGAT1 (0.41) DGAT1LPLLIPG
SCHEMBL23956047 0.74 DGAT1 (0.42) DGAT1LPLLIPG
SCHEMBL19295084 0.73 DGAT1 (0.47) DGAT1LPLLIPG
SCHEMBL21662364 0.73 DGAT1 (0.43) DGAT1LPLLIPG
SCHEMBL21662278 0.73 DGAT1 (0.41) DGAT1LPLLIPG
SCHEMBL23343403 0.73 GRM5 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11136343-B2 Binuclear metal complexes for use as emitters in organic electroluminescent devices MERCK PATENT GMBH (DE) 2021-10-05 US disclosed
US-20190292210-A1 BINUCLEAR METAL COMPLEXES FOR USE AS EMITTERS IN ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-09-26 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-20190292210-A1 BINUCLEAR METAL COMPLEXES FOR USE AS EMITTERS IN ORGANIC ELECTROLUMINESCENT DEVICES AP2M1, MCU, AP3M1 DGAT1 1147/4885HIF1A 4882/4885LPL 3633/4885
US-11136343-B2 Binuclear metal complexes for use as emitters in organic electroluminescent devices AP2M1, MCU, AP3M1 DGAT1 1147/4885HIF1A 4882/4885LPL 3633/4885

“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.