SCHEMBL21718293

SCHEMBL21718293

CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4c5ccccc5cc5c4c4cccc6c7c(-c8ccc(-c9ccc%10c(c9)C(C)(C)c9ccccc9-%10)cc8)c8ccccc8cc7n5c46)cc3)cc21

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 10/20 0.32
CES1 P23141 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 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
SCHEMBL21718028 0.95 CES1 (0.32) PDK2CES1
SCHEMBL21717633 0.92 GPR84 (0.33) PDK2
SCHEMBL21710719 0.91 CES1 (0.32) CES1
SCHEMBL21718299 0.89 CES1 (0.32) CES1
SCHEMBL21717631 0.88 ALOX5 (0.31)
SCHEMBL21718072 0.84 CES1 (0.33) CES1
SCHEMBL21718035 0.83 ALOX5 (0.31)
SCHEMBL21718063 0.82 CES1 (0.34) CES1
SCHEMBL21717622 0.82 PDK2 (0.36) PDK2
SCHEMBL21718291 0.82 CES1 (0.34) CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200052225-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2020-02-13 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 (1 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-20200052225-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE LEF1, L1CAM, ESR2 PDK2 1229/4885CES1 2299/4885CA12 1890/4885

“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.