SCHEMBL16244938

SCHEMBL16244938

Cc1ccc(S(=O)(=O)n2c(-c3cn(C)c4ncccc34)cc3c4c(cnc32)cnn4C)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 8/20 0.42
▸ LATS1 O95835 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ MET P08581 1/20 0.36
▸ DYRK1A Q13627 1/20 0.34
▸ PCSK9 Q8NBP7 1/20 0.34
▸ CCKAR P32238 1/20 0.34
▸ CDK2 P24941 3/20 0.34
▸ CCNE1 P24864 2/20 0.34
▸ BRD4 O60885 1/20 0.33
▸ CDK1 P06493 1/20 0.33
▸ CCNB1 P14635 1/20 0.33
▸ GSK3B P49841 1/20 0.33
▸ CCNT1 O60563 1/20 0.33
▸ PIM1 P11309 1/20 0.33
▸ CCNA2 P20248 1/20 0.33
▸ CDK9 P50750 1/20 0.33
▸ CDK5 Q00535 1/20 0.33
▸ CDK5R1 Q15078 1/20 0.33

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
SCHEMBL2318455 0.89 PTGDR2 (0.34) PTGDR2LATS1L3MBTL1PCSK9BRD4
SCHEMBL2322259 0.86 PTGDR2 (0.39) PTGDR2LATS1L3MBTL1
SCHEMBL2319229 0.86 LATS1 (0.35) PTGDR2LATS1L3MBTL1PCSK9BRD4
SCHEMBL2315327 0.84 LMNA (0.43) PTGDR2METPCSK9BRD4CDK1
SCHEMBL1932988 0.84 PCSK9 (0.35) PTGDR2PCSK9BRD4
SCHEMBL2314750 0.83 PTGS1 (0.37) PTGDR2LATS1L3MBTL1BRD4
SCHEMBL2317803 0.82 PCSK9 (0.38) PTGDR2L3MBTL1PCSK9CDK2CCNT1
SCHEMBL2319582 0.82 EED (0.39) METGSK3BPIM1CDK9CDK5
SCHEMBL2319238 0.82 CYP11B1 (0.39) PTGDR2LATS1L3MBTL1
SCHEMBL1933394 0.82 PCSK9 (0.34) PTGDR2PCSK9BRD4

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-20140349970-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2014-11-27 — — 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-20140349970-A1 NOVEL TRICYCLIC COMPOUNDS CCNI, IL2, IL4I1 PTGDR2 237/4885LATS1 3397/4885L3MBTL1 4805/4885

“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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