SCHEMBL1933934

SCHEMBL1933934

Cc1ccc(S(=O)(=O)n2ccc3nc(/C=N/[S@@+]([O-])C(C)(C)C)cnc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
ALDH3A1 P30838 2/20 0.35
POLB P06746 1/20 0.35
HTT P42858 1/20 0.35
NOD1 Q9Y239 1/20 0.35
BRD4 O60885 1/20 0.33
RAPGEF4 Q8WZA2 2/20 0.32
PKM P14618 1/20 0.32
CYP2C19 P33261 1/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
MET P08581 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
SCHEMBL1933932 1.00 L3MBTL1 (0.43) L3MBTL1ALDH3A1POLBHTTNOD1
SCHEMBL1933935 1.00 L3MBTL1 (0.43) L3MBTL1ALDH3A1POLBHTTNOD1
SCHEMBL1933936 1.00 L3MBTL1 (0.43) L3MBTL1ALDH3A1POLBHTTNOD1
SCHEMBL12054172 0.84 L3MBTL1 (0.42) L3MBTL1ALDH3A1POLBHTTNOD1
SCHEMBL4348792 0.83 L3MBTL1 (0.48) L3MBTL1ALDH3A1POLBHTTNOD1
SCHEMBL4348791 0.83 L3MBTL1 (0.48) L3MBTL1ALDH3A1POLBHTTNOD1
SCHEMBL28800882 0.82 L3MBTL1 (0.44) L3MBTL1ALDH3A1POLBHTTNOD1
SCHEMBL1536113 0.80 L3MBTL1 (0.52) L3MBTL1ALDH3A1POLBHTTNOD1
SCHEMBL12555053 0.79 L3MBTL1 (0.51) L3MBTL1ALDH3A1POLBHTTNOD1
SCHEMBL15202692 0.78 L3MBTL1 (0.48) L3MBTL1ALDH3A1POLBHTTNOD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3950692-A1 NOVEL TRICYCLIC COMPOUNDS AbbVie Inc. (US) 2022-02-09 EP disclosed
US-20210061813-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2021-03-04 US disclosed
US-20210061813-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2021-03-04 US disclosed
US-RE47221-E1 Tricyclic compounds ABBVIE INC. (US) 2019-02-05 US disclosed
US-RE47221-E1 Tricyclic compounds ABBVIE INC. (US) 2019-02-05 US disclosed
EP-3266786-A1 NOVEL TRICYCLIC COMPOUNDS AbbVie Inc. (US) 2018-01-10 EP disclosed
EP-2506716-B1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC (US) 2017-05-17 EP disclosed
US-20160222020-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2016-08-04 US disclosed
US-20160222020-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2016-08-04 US disclosed
US-20160222020-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2016-08-04 US disclosed
US-20130216497-A1 NOVEL TRICYCLIC COMPOUNDS ABBOTT LABORATORIES 2013-08-22 US disclosed
US-20130216497-A1 NOVEL TRICYCLIC COMPOUNDS ABBOTT LABORATORIES 2013-08-22 US disclosed
US-20130216497-A1 NOVEL TRICYCLIC COMPOUNDS ABBOTT LABORATORIES 2013-08-22 US disclosed
US-8426411-B2 Tricyclic compounds ABBOTT LABORATORIES (US) 2013-04-23 US disclosed
US-8426411-B2 Tricyclic compounds ABBOTT LABORATORIES (US) 2013-04-23 US disclosed
EP-2506716-A1 NOVEL TRICYCLIC COMPOUNDS Abbott Laboratories (US) 2012-10-10 EP disclosed
US-20110311474-A1 Novel Tricyclic Compounds ABBOTT LABORATORIES (US) 2011-12-22 US disclosed
US-20110311474-A1 Novel Tricyclic Compounds ABBOTT LABORATORIES (US) 2011-12-22 US disclosed
WO-2011068881-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 (4 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-20210061813-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 L3MBTL1 4591/4885ALDH3A1 1008/4885POLB 2750/4885
US-20160222020-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 L3MBTL1 4591/4885ALDH3A1 1008/4885POLB 2750/4885
US-20110311474-A1 Novel Tricyclic Compounds CYP11B2, CYP11B1, ABCB1 L3MBTL1 4591/4885ALDH3A1 1008/4885POLB 2750/4885
US-20130216497-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 L3MBTL1 4591/4885ALDH3A1 1008/4885POLB 2750/4885

“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.