SCHEMBL12307208

SCHEMBL12307208

CCCCCCN1c2ccccc2C(C)(C)c2cc(-c3ccc4cc5sc6c7cc8cc(/C=c9/s/c(=C(\C#N)C(=O)O)n(CC(=O)O)c9=O)ccc8cc7sc6c5cc4c3)ccc21

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CHEK2 O96017 1/20 0.34
▸ RPS6KB1 P23443 1/20 0.34
▸ MARK3 P27448 1/20 0.34
▸ FLT4 P35916 1/20 0.34
▸ KDR P35968 1/20 0.34
▸ NEK2 P51955 1/20 0.34
▸ PLK1 P53350 1/20 0.34
▸ DYRK1A Q13627 1/20 0.34
▸ MARK2 Q7KZI7 1/20 0.34
▸ PLK3 Q9H4B4 1/20 0.34
▸ SGK2 Q9HBY8 1/20 0.34
▸ RECQL P46063 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL12307189 0.89 CHEK2 (0.35) CHEK2RPS6KB1MARK3FLT4KDR
SCHEMBL12307206 0.83 PTGES (0.31) —
SCHEMBL16556957 0.82 CHEK2 (0.31) CHEK2RPS6KB1MARK3FLT4KDR
SCHEMBL12307156 0.82 PLK1 (0.40) CHEK2RPS6KB1MARK3FLT4KDR
SCHEMBL12335531 0.80 CHEK2 (0.33) CHEK2RPS6KB1MARK3FLT4KDR
SCHEMBL12307019 0.77 PLK1 (0.43) CHEK2RPS6KB1MARK3FLT4KDR
SCHEMBL12307211 0.75 — —
SCHEMBL16556883 0.75 CHEK2 (0.35) CHEK2RPS6KB1MARK3FLT4KDR
SCHEMBL12334515 0.73 PLK1 (0.43) CHEK2RPS6KB1MARK3FLT4KDR
SCHEMBL12307168 0.73 CHEK2 (0.32) CHEK2RPS6KB1MARK3FLT4KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9424998-B2 Dye, photoelectric conversion element using the same, photoelectrochemical cell, and method of producing dye FUJIFILM CORPORATION (JP) 2016-08-23 — — US disclosed
US-8779126-B2 Dye, photoelectric conversion element using the same, photoelectrochemical cell, and method of producing dye FUJIFILM CORPORATION (JP) 2014-07-15 — — US disclosed
US-20110213144-A1 DYE, PHOTOELECTRIC CONVERSION ELEMENT USING THE SAME, PHOTOELECTROCHEMICAL CELL, AND METHOD OF PRODUCING DYE FUJIFILM CORPORATION (JP) 2011-09-01 — — 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-20110213144-A1 DYE, PHOTOELECTRIC CONVERSION ELEMENT USING THE SAME, PHOTOELECTROCHEMICAL CELL, AND METHOD OF PRODUCING DYE CYBA, SCN3A, CRY1 CHEK2 2769/4885RPS6KB1 2931/4885MARK3 898/4885

“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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