SCHEMBL2319349

SCHEMBL2319349

COc1ccc(-c2cc3c4c(cnc3n2S(=O)(=O)c2ccc(C)cc2)cnn4C)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ FLT3 P36888 1/20 0.39
▸ PTGS2 P35354 4/20 0.39
▸ PTGS1 P23219 3/20 0.39
▸ PTGDR2 Q9Y5Y4 1/20 0.38
▸ GBA1 P04062 1/20 0.37
▸ LMNA P02545 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ KCNQ1 P51787 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ THRB P10828 1/20 0.35

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 0.87 LATS1 (0.37) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL2319171 0.87 ESRRG (0.41) ALDH1A1TSHRHTT
SCHEMBL2320144 0.86 PTGS2 (0.33) ALDH1A1MEN1KMT2APTGS2PTGS1
SCHEMBL2317775 0.85 HTR6 (0.38) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL2319582 0.85 EED (0.39) KDM4EKMT2AFLT3
SCHEMBL2319888 0.84 PTPN11 (0.34) ALDH1A1KDM4EMEN1KMT2APTGS2
SCHEMBL12444978 0.83 EED (0.38) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL1933995 0.83 MAPT (0.44) MAPTKDM4ELMNAHTTGAA
SCHEMBL2317034 0.83 ACHE (0.46) FLT3PTGS2
SCHEMBL2319238 0.83 CYP11B1 (0.39) PTGS2PTGS1PTGDR2GBA1L3MBTL1

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-20140349970-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2014-11-27 — — US disclosed
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 (2 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 MAPT 3798/4885ALDH1A1 305/4885KDM4E 3487/4885
US-20110190489-A1 Novel Tricyclic Compounds CCNI, IL2, IL4I1 MAPT 3798/4885ALDH1A1 305/4885KDM4E 3487/4885

“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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