SCHEMBL2314750

SCHEMBL2314750

Cc1ccc(S(=O)(=O)n2c(-c3ccc(C)cc3C)cc3c4c(cnc32)cnn4C)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 1/20 0.37
▸ PTGS2 P35354 1/20 0.37
▸ PTGDR2 Q9Y5Y4 1/20 0.33
▸ ALDH3A1 P30838 2/20 0.33
▸ LATS1 O95835 1/20 0.32
▸ PKM P14618 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ NOD1 Q9Y239 2/20 0.32
▸ CXCL8 P10145 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ NOD2 Q9HC29 1/20 0.32
▸ LMNA P02545 3/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ SCN9A Q15858 1/20 0.31
▸ BRD4 O60885 1/20 0.31
▸ PDE2A O00408 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HTT P42858 2/20 0.31
▸ POLB P06746 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
SCHEMBL2320310 0.86 LATS1 (0.37) PTGS1PTGS2PTGDR2ALDH3A1LATS1
SCHEMBL2318455 0.83 PTGDR2 (0.34) PTGDR2LATS1L3MBTL1LMNABRD4
SCHEMBL16244938 0.83 PTGDR2 (0.42) PTGDR2LATS1L3MBTL1BRD4
SCHEMBL2322259 0.82 PTGDR2 (0.39) PTGDR2ALDH3A1LATS1L3MBTL1NOD1
SCHEMBL2316775 0.82 GAA (0.35) PTGDR2ALDH3A1LATS1L3MBTL1NOD1
SCHEMBL2318104 0.82 PTGDR2 (0.36) PTGDR2ALDH3A1LATS1PKMNPC1
SCHEMBL2315327 0.81 LMNA (0.43) PTGDR2ALDH3A1LMNABRD4ALDH1A1
SCHEMBL2319229 0.81 LATS1 (0.35) PTGDR2ALDH3A1LATS1L3MBTL1NOD1
SCHEMBL1932988 0.81 PCSK9 (0.35) PTGDR2ALDH3A1LMNASCN9ABRD4
SCHEMBL2319349 0.81 MAPT (0.41) PTGS1PTGS2PTGDR2L3MBTL1GAA

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-8785639-B2 Substituted dihydropyrazolo[3,4-D]pyrrolo[2,3-B]pyridines and methods of use thereof ABBVIE INC. (US) 2014-07-22 — — US disclosed
US-20110190489-A1 Novel Tricyclic Compounds ABBOTT LABORATORIES (US) 2011-08-04 — — 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-20110190489-A1 Novel Tricyclic Compounds CCNI, IL2, IL4I1 PTGS1 162/4885PTGS2 167/4885PTGDR2 237/4885

“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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