SCHEMBL1933897

SCHEMBL1933897

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
UBE2N P61088 1/20 0.40
ALDH1A1 P00352 4/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
LMNA P02545 2/20 0.39
EPHX2 P34913 1/20 0.39
NOD2 Q9HC29 1/20 0.38
NOD1 Q9Y239 1/20 0.38
TP53 P04637 3/20 0.37
CCR6 P51684 2/20 0.37
ACHE P22303 1/20 0.37
PKM P14618 1/20 0.36
HTR6 P50406 2/20 0.35
MAPT P10636 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
PDE4B Q07343 1/20 0.35
BDKRB1 P46663 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL23061211 0.91 NOD2 (0.40) KDM4EL3MBTL1ALDH1A1CYP3A4TSHR
SCHEMBL20706502 0.90 L3MBTL1 (0.39) KDM4EL3MBTL1ALDH1A1CYP3A4TSHR
SCHEMBL15203404 0.89 L3MBTL1 (0.42) KDM4EL3MBTL1ALDH1A1CYP3A4TSHR
SCHEMBL9989458 0.87 L3MBTL1 (0.41) KDM4EL3MBTL1ALDH1A1CYP3A4TSHR
SCHEMBL1935252 0.85 ALDH1A1 (0.36) KDM4EL3MBTL1ALDH1A1CYP3A4TSHR
SCHEMBL28917554 0.85 ALDH1A1 (0.36) KDM4EL3MBTL1ALDH1A1CYP3A4TSHR
SCHEMBL1935255 0.85 ALDH1A1 (0.36) KDM4EL3MBTL1ALDH1A1CYP3A4TSHR
SCHEMBL9991927 0.84 CDK2 (0.39) L3MBTL1ALDH1A1CYP3A4TSHRLMNA
SCHEMBL1934468 0.84 ALDH1A1 (0.39) KDM4EL3MBTL1ALDH1A1CYP3A4TSHR
SCHEMBL12555136 0.82 CCR6 (0.37) KDM4EL3MBTL1ALDH1A1CYP3A4TSHR

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3950692-A1 NOVEL TRICYCLIC COMPOUNDS AbbVie Inc. (US) 2022-02-09 EP disclosed
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
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-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
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 KDM4E 4131/4885L3MBTL1 4591/4885UBE2N 2967/4885
US-20160222020-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 KDM4E 4131/4885L3MBTL1 4591/4885UBE2N 2967/4885
US-20110311474-A1 Novel Tricyclic Compounds CYP11B2, CYP11B1, ABCB1 KDM4E 4131/4885L3MBTL1 4591/4885UBE2N 2967/4885
US-20130216497-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 KDM4E 4131/4885L3MBTL1 4591/4885UBE2N 2967/4885

“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.