SCHEMBL1933398

SCHEMBL1933398

Cc1ccc(S(=O)(=O)n2ccc3c(Cl)c(CC=O)cnc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
BRD4 O60885 5/20 0.43
POLB P06746 1/20 0.38
ALDH3A1 P30838 1/20 0.38
HTT P42858 1/20 0.38
NOD1 Q9Y239 1/20 0.38
HTR6 P50406 3/20 0.38
RAPGEF4 Q8WZA2 1/20 0.37
PKM P14618 2/20 0.37
KDM4E B2RXH2 1/20 0.37
UBE2N P61088 1/20 0.37
PDE4A P27815 2/20 0.36
PDE4B Q07343 2/20 0.36
PDE4C Q08493 2/20 0.36
PDE4D Q08499 2/20 0.36
CYP19A1 P11511 1/20 0.35
VEGFA P15692 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34

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
SCHEMBL1935157 0.90 L3MBTL1 (0.44) L3MBTL1BRD4POLBALDH3A1HTT
SCHEMBL1934207 0.89 L3MBTL1 (0.43) L3MBTL1BRD4POLBALDH3A1HTT
SCHEMBL18855947 0.84 HTR6 (0.49) L3MBTL1BRD4POLBALDH3A1HTT
SCHEMBL1933799 0.82 L3MBTL1 (0.47) L3MBTL1BRD4POLBALDH3A1HTT
SCHEMBL1933333 0.82 L3MBTL1 (0.43) L3MBTL1BRD4POLBALDH3A1HTT
SCHEMBL18855944 0.82 L3MBTL1 (0.43) L3MBTL1BRD4POLBALDH3A1HTT
SCHEMBL25425961 0.82 L3MBTL1 (0.43) L3MBTL1POLBALDH3A1HTTNOD1
SCHEMBL1356064 0.82 L3MBTL1 (0.51) L3MBTL1BRD4POLBALDH3A1HTT
SCHEMBL30509477 0.82 L3MBTL1 (0.51) L3MBTL1BRD4POLBALDH3A1HTT
SCHEMBL16052697 0.82 L3MBTL1 (0.51) L3MBTL1BRD4POLBALDH3A1HTT

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 13 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-20140349970-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2014-11-27 US disclosed
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-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-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
EP-2506713-A1 NOVEL TRICYCLIC COMPOUNDS Abbott Laboratories (US) 2012-10-10 EP disclosed
CN-102711470-A Novel tricyclic compounds ABBOTT LAB 2012-10-03 CN disclosed
US-20110190489-A1 Novel Tricyclic Compounds ABBOTT LABORATORIES (US) 2011-08-04 US disclosed
US-20110190489-A1 Novel Tricyclic Compounds ABBOTT LABORATORIES (US) 2011-08-04 US disclosed
US-20110190489-A1 Novel Tricyclic Compounds ABBOTT LABORATORIES (US) 2011-08-04 US disclosed
WO-2011068899-A1 NOVEL TRICYCLIC COMPOUNDS ABBOTT LABORATORIES (US) 2011-06-09 WO disclosed
WO-2011068899-A1 NOVEL TRICYCLIC COMPOUNDS ABBOTT LABORATORIES (US) 2011-06-09 WO 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 L3MBTL1 4805/4885BRD4 1047/4885POLB 2384/4885
US-20110190489-A1 Novel Tricyclic Compounds CCNI, IL2, IL4I1 L3MBTL1 4805/4885BRD4 1047/4885POLB 2384/4885

“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.