SCHEMBL1935255

SCHEMBL1935255

Cc1ccc(S(=O)(=O)n2ccc3c(NC4CCCCC4)c(C=CC4OCCO4)cnc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
PDE4B Q07343 1/20 0.35
NOD2 Q9HC29 1/20 0.35
NOD1 Q9Y239 1/20 0.35
CYP3A4 P08684 1/20 0.34
TSHR P16473 1/20 0.34
LMNA P02545 3/20 0.34
EPHX2 P34913 1/20 0.34
CCR6 P51684 2/20 0.34
HTR6 P50406 3/20 0.34
MAPT P10636 1/20 0.34
TP53 P04637 3/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 2/20 0.32
PKM P14618 1/20 0.32

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
SCHEMBL1935252 1.00 ALDH1A1 (0.36) ALDH1A1GAAL3MBTL1PDE4BNOD2
SCHEMBL28917554 1.00 ALDH1A1 (0.36) ALDH1A1GAAL3MBTL1PDE4BNOD2
SCHEMBL20706502 0.87 L3MBTL1 (0.39) ALDH1A1GAAL3MBTL1PDE4BNOD2
SCHEMBL1933897 0.85 KDM4E (0.40) ALDH1A1GAAL3MBTL1PDE4BNOD2
SCHEMBL23061211 0.85 NOD2 (0.40) ALDH1A1GAAL3MBTL1PDE4BNOD2
SCHEMBL1935258 0.83 L3MBTL1 (0.38) ALDH1A1GAAL3MBTL1PDE4BNOD1
SCHEMBL27889781 0.83 TP53 (0.40) ALDH1A1L3MBTL1PDE4BTSHRLMNA
SCHEMBL28604352 0.83 L3MBTL1 (0.39) L3MBTL1PDE4BHTR6MAPTKDM4E
SCHEMBL12035832 0.83 L3MBTL1 (0.39) L3MBTL1PDE4BHTR6MAPTKDM4E
SCHEMBL15203404 0.82 L3MBTL1 (0.42) ALDH1A1GAAL3MBTL1NOD2NOD1

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 17 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
CN-109053742-B Novel tricyclic compounds ABBVIE 公司 2021-06-15 CN 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
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-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
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
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 ALDH1A1 340/4885GAA 1449/4885L3MBTL1 4591/4885
US-20160222020-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 ALDH1A1 340/4885GAA 1449/4885L3MBTL1 4591/4885
US-20110311474-A1 Novel Tricyclic Compounds CYP11B2, CYP11B1, ABCB1 ALDH1A1 340/4885GAA 1449/4885L3MBTL1 4591/4885
US-20130216497-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 ALDH1A1 340/4885GAA 1449/4885L3MBTL1 4591/4885

“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.