SCHEMBL4352397

SCHEMBL4352397

Cc1ccc(S(=O)(=O)n2ccc3nc(N(CC(=O)C4CN(C(=O)OCC5c6ccccc6-c6ccccc65)CCC4C)C(=O)OC(C)(C)C)cnc32)cc1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 2/20 0.32
HTR6 P50406 2/20 0.31
BCHE P06276 1/20 0.31
GPR119 Q8TDV5 1/20 0.30
PIK3CD O00329 1/20 0.30
GRIN2B Q13224 1/20 0.30

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
SCHEMBL1536932 0.90 HTR6 (0.34) HTR6BCHE
SCHEMBL4346387 0.90 HTR6 (0.34) HTR6BCHE
SCHEMBL1536129 0.90 GRIN2B (0.39) ADAM17HTR6BCHEGPR119PIK3CD
SCHEMBL13579580 0.88
SCHEMBL27819082 0.87 GPR119 (0.33) ADAM17HTR6BCHEGPR119
SCHEMBL14791222 0.84 GRIN2B (0.35) ADAM17GPR119PIK3CDGRIN2B
SCHEMBL1535996 0.83 ALDH1A1 (0.32) GPR119GRIN2B
SCHEMBL1536933 0.83 ALOX5 (0.32) HTR6BCHE
SCHEMBL1536931 0.83 ALOX5 (0.32) HTR6BCHE
SCHEMBL14779678 0.82 L3MBTL1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180291029-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2018-10-11 US disclosed
US-20160326181-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2016-11-10 US disclosed
EP-3031324-A2 TRICYCLIC KINASE INHIBITORS AbbVie Inc. (US) 2016-06-15 EP disclosed
US-9365579-B2 Tricyclic compounds ABBVIE INC. (US) 2016-06-14 US disclosed
EP-2299821-B1 TRICYCLIC COMPOUNDS ABBVIE INC (US) 2015-11-04 EP disclosed
US-20150210708-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2015-07-30 US disclosed
US-8962629-B2 Tricyclic compounds ABBVIE INC. (US) 2015-02-24 US disclosed
US-20090312338-A1 Novel Tricyclic Compounds ABBOTT LABORATORIES (US) 2009-12-17 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 (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-20180291029-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 ADAM17 2043/4885HTR6 1737/4885BCHE 2704/4885
US-20090312338-A1 Novel Tricyclic Compounds CYP11B2, CYP11B1, ABCB1 ADAM17 2043/4885HTR6 1737/4885BCHE 2704/4885
US-20160326181-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 ADAM17 2043/4885HTR6 1737/4885BCHE 2704/4885
US-20150210708-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 ADAM17 2043/4885HTR6 1737/4885BCHE 2704/4885

“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.