SCHEMBL2574159

SCHEMBL2574159

Cc1ccc2ccccc2c1S(=O)(=O)Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 4/20 0.50
TSHR P16473 4/20 0.50
CYP1A2 P05177 3/20 0.50
PAX8 Q06710 1/20 0.45
ALDH1A1 P00352 3/20 0.43
HPRT1 P00492 1/20 0.43
HSD17B10 Q99714 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
HPGD P15428 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MAPT P10636 2/20 0.39
KEAP1 Q14145 1/20 0.38
KMT2A Q03164 1/20 0.38
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
GRIN2B Q13224 1/20 0.37
GRIN2C Q14957 1/20 0.37
GRIN3A Q8TCU5 1/20 0.37

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
SCHEMBL3844980 0.86 CYP2A6 (0.56) CYP2A6TSHRCYP1A2PAX8ALDH1A1
SCHEMBL5610250 0.82 CYP2A6 (0.52) CYP2A6TSHRCYP1A2PAX8ALDH1A1
SCHEMBL31603822 0.82 CYP2A6 (0.52) CYP2A6TSHRCYP1A2PAX8ALDH1A1
SCHEMBL498824 0.82 CYP2A6 (0.52) CYP2A6TSHRCYP1A2PAX8ALDH1A1
SCHEMBL8418133 0.81 CA1 (0.50) CYP2A6TSHRCYP1A2ALDH1A1HSD17B10
SCHEMBL152855 0.81 CYP2A6 (0.50) CYP2A6TSHRCYP1A2ALDH1A1HSD17B10
Ammonia Solution, Strong SCHEMBL3224172 0.79 CYP1A2 (0.48) CYP2A6TSHRCYP1A2ALDH1A1HSD17B10
SCHEMBL3209447 0.79 CYP1A2 (0.48) CYP2A6TSHRCYP1A2ALDH1A1HSD17B10
Lithium SCHEMBL31255851 0.79 CYP1A2 (0.48) CYP2A6TSHRCYP1A2ALDH1A1HSD17B10
SCHEMBL31214802 0.79 CYP1A2 (0.48) CYP2A6TSHRCYP1A2ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200115357-A1 LIVER X RECEPTORS (LXR) MODULATORS PHENEX-FXR GMBH (DE) 2020-04-16 US disclosed
US-20200115357-A1 LIVER X RECEPTORS (LXR) MODULATORS PHENEX-FXR GMBH (DE) 2020-04-16 US disclosed
EP-3609880-A1 LIVER X RECEPTORS (LXR) MODULATORS Phenex-FXR GmbH (DE) 2020-02-19 EP disclosed
CN-110546144-A Liver X Receptor (LXR) modulators PHENEX FXR GMBH 2019-12-06 CN disclosed
WO-2018188795-A1 LIVER X RECEPTORS (LXR) MODULATORS PHENEX-FXR GMBH (DE) 2018-10-18 WO disclosed
US-8580965-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-11-12 US disclosed
US-8580965-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-11-12 US disclosed
EP-2066659-B1 SUBSTITUTED SULFONAMIDE DERIVATIVES GRUENENTHAL GMBH (DE) 2013-08-28 EP disclosed
EP-2066659-B1 SUBSTITUTED SULFONAMIDE DERIVATIVES GRUENENTHAL GMBH (DE) 2013-08-28 EP disclosed
US-8435978-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-05-07 US disclosed
CN-1256324-C Pyrrolidine derivatives as factor Xa inhibitors GLAXO GROUP LTD (GB) 2006-05-17 CN disclosed
CN-1538955-A Pyrrolidine derivatives as factor Xa inhibitors 2004-10-20 CN disclosed
EP-1104424-B1 PROCESS FOR THE SYNTHESIS OF CARBAPENEM INTERMEDIATES MERCK & CO INC (US) 2004-04-07 EP disclosed
US-6489471-B1 A PROCESS OF SYNTHESIZING A CARBAPENEM COMPOUND OF FORMULA (6) IS DISCLOSED, WHEREIN R REPRESENTS H OR METHYL, P AND P* INDEPENDENTLY REPRESENT H OR PROTECTING GROUPS AND EACH R.SUP.1 IS INDEPENDENTLY SELECTED FROM: H, HALO, OH, OP MERCK & CO., INC. 2002-12-03 US disclosed
EP-1104424-A4 PROCESS FOR THE SYNTHESIS OF CARBAPENEM INTERMEDIATES, AND COMPOUNDS PRODUCED MERCK & CO INC (US) 2002-01-23 EP disclosed
EP-1104424-A1 PROCESS FOR THE SYNTHESIS OF CARBAPENEM INTERMEDIATES, AND COMPOUNDS PRODUCED Merck & Co., Inc. (US) 2001-06-06 EP disclosed
EP-0981522-A1 PROCESS FOR SYNTHESIZING CARBAPENEM INTERMEDIATES Merck & Co., Inc. (US) 2000-03-01 EP disclosed
WO-1999065921-A1 PROCESS FOR THE SYNTHESIS OF CARBAPENEM INTERMEDIATES, AND COMPOUNDS PRODUCED MERCK & CO., INC. (US) 1999-12-23 WO disclosed
US-5908936-A Process for synthesizing carbapenem intermediates MERCK & CO., INC. (US) 1999-06-01 US disclosed
WO-1998051677-A1 PROCESS FOR SYNTHESIZING CARBAPENEM INTERMEDIATES MERCK & CO., INC. (US) 1998-11-19 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 (1 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-20200115357-A1 LIVER X RECEPTORS (LXR) MODULATORS NR1H2, NR1H3, NR1H4 CYP2A6 396/4885TSHR 136/4885CYP1A2 521/4885

“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.