SCHEMBL1935172

SCHEMBL1935172

Cc1ccc(S(=O)(=O)n2ccc3nc(N(C)C(=S)[C@H]4CN(C(=O)OC(C)(C)C)CC[C@H]4C)cnc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.39
PIK3CD O00329 1/20 0.37
MMP13 P45452 1/20 0.36
CYP3A4 P08684 1/20 0.35
ADAM17 P78536 1/20 0.35
USP30 Q70CQ3 2/20 0.35
HTR6 P50406 1/20 0.34
TGM2 P21980 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
SCHEMBL1933877 0.93 USP30 (0.39) GPR119PIK3CDMMP13CYP3A4ADAM17
SCHEMBL4355056 0.93 USP30 (0.39) GPR119PIK3CDMMP13CYP3A4ADAM17
SCHEMBL9990716 0.88 HTR6 (0.38) GPR119PIK3CDMMP13ADAM17USP30
SCHEMBL1934086 0.88 HTR6 (0.38) GPR119PIK3CDMMP13ADAM17USP30
SCHEMBL28589631 0.84 USP30 (0.44) GPR119PIK3CDMMP13ADAM17USP30
SCHEMBL1935238 0.84 USP30 (0.44) GPR119PIK3CDMMP13ADAM17USP30
SCHEMBL4354349 0.83 L3MBTL1 (0.36)
SCHEMBL1935169 0.83 HTR6 (0.38) GPR119MMP13CYP3A4ADAM17HTR6
SCHEMBL1536189 0.81 TACR1 (0.39) GPR119MMP13CYP3A4ADAM17HTR6
SCHEMBL18855538 0.81 TACR1 (0.39) GPR119MMP13CYP3A4ADAM17HTR6

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 11 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-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-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
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
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 GPR119 1060/4885PIK3CD 1961/4885MMP13 3599/4885
US-20160222020-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 GPR119 1060/4885PIK3CD 1961/4885MMP13 3599/4885
US-20110311474-A1 Novel Tricyclic Compounds CYP11B2, CYP11B1, ABCB1 GPR119 1060/4885PIK3CD 1961/4885MMP13 3599/4885
US-20130216497-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 GPR119 1060/4885PIK3CD 1961/4885MMP13 3599/4885

“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.