SCHEMBL25757472

SCHEMBL25757472

CC1(C)c2cc(C#N)ccc2-c2ccc(-c3cc(C#N)cc(-c4ccc5c(c4)C(C)(C)c4cc(C#N)ccc4-5)c3)cc21

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 15/20 0.48
▸ PDK2 Q15119 3/20 0.44
▸ ALK Q9UM73 1/20 0.42
▸ NR3C1 P04150 1/20 0.41
▸ NR3C2 P08235 1/20 0.41
▸ AR P10275 1/20 0.41

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
SCHEMBL13563095 0.98 PGR (0.47) PGRPDK2ALKNR3C1NR3C2
SCHEMBL26506713 0.90 PDK2 (0.51) PGRPDK2ALK
SCHEMBL23873746 0.88 PGR (0.45) PGRPDK2ALKAR
SCHEMBL14261879 0.87 ALK (0.46) PGRPDK2ALK
SCHEMBL18914750 0.86 PGR (0.53) PGRPDK2ALKAR
SCHEMBL15763534 0.84 PGR (0.46) PGRPDK2ALK
SCHEMBL30709050 0.83 PGR (0.51) PGRPDK2ALKAR
SCHEMBL19939365 0.82 PGR (0.43) PGRPDK2ALK
SCHEMBL21658236 0.82 PGR (0.43) PGRPDK2ALK
SCHEMBL17297043 0.82 PGR (0.47) PGRPDK2ALKAR

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
WO-2023120315-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT キヤノン株式会社 2023-06-29 — — WO disclosed
US-20230139115-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2023-05-04 — — 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-20230139115-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE OR10J3, MLX, RPS4X PGR 613/4885PDK2 4263/4885ALK 505/4885

“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.

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