SCHEMBL531949

SCHEMBL531949

Cc1cc(C(F)(F)F)cc(C)c1I

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 3/20 0.42
AGBL2 Q5U5Z8 1/20 0.37
CES2 O00748 1/20 0.37
RXRA P19793 2/20 0.36
RXRB P28702 2/20 0.36
XPO1 O14980 1/20 0.35
NR2E1 Q9Y466 1/20 0.34
MAPT P10636 1/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRB2 P47870 1/20 0.33
GABRA4 P48169 1/20 0.33
GABRE P78334 1/20 0.33

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
SCHEMBL22366935 0.85 GABRB3 (0.43) RAPGEF4GABRPGABRDGABRA1GABRB1
SCHEMBL17954015 0.85 RAPGEF4 (0.37) RAPGEF4CES2RXRARXRBXPO1
SCHEMBL18299579 0.84 IL1B (0.36) RAPGEF4CES2RXRARXRB
SCHEMBL25798292 0.84 GABRB3 (0.36) RAPGEF4CES2RXRARXRBXPO1
SCHEMBL18299676 0.84 PTPN5 (0.41) RAPGEF4RXRARXRBNR2E1MAPT
SCHEMBL532742 0.80 RAPGEF4 (0.34) RAPGEF4AGBL2RXRARXRBIDO1
SCHEMBL30743622 0.80 ABCG2 (0.37) RAPGEF4MAPTPDE2A
SCHEMBL22654828 0.80 ABCG2 (0.37) RAPGEF4MAPTPDE2A
SCHEMBL3140759 0.79 AGBL2 (0.32) AGBL2
SCHEMBL25405083 0.78 KDM4E (0.33) RAPGEF4AGBL2IDO1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240002374-A1 5-MEMBERED HETEROARYLAMINOSULFONAMIDES FOR TREATING CONDITIONS MEDIATED BY DEFICIENT CFTR ACTIVITY GENZYME CORPORATION 2024-01-04 US disclosed
US-20230099293-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2023-03-30 US disclosed
EP-4077323-A1 OGA INHIBITOR COMPOUNDS Janssen Pharmaceutica NV (BE) 2022-10-26 EP disclosed
EP-4058439-A1 5-MEMBERED HETEROARYLAMINOSULFONAMIDES FOR TREATING CONDITIONS MEDIATED BY DEFICIENT CFTR ACTIVITY Genzyme Corporation (US) 2022-09-21 EP disclosed
CN-115003659-A 5-membered heteroaryl amino sulfonamides for the treatment of conditions mediated by a deficiency in CFTR activity 健赞公司 2022-09-02 CN disclosed
CN-114867725-A OGA inhibitor compounds 詹森药业有限公司 2022-08-05 CN disclosed
WO-2021097057-A1 5-MEMBERED HETEROARYLAMINOSULFONAMIDES FOR TREATING CONDITIONS MEDIATED BY DEFICIENT CFTR ACTIVITY GENZYME CORPORATION (US) 2021-05-20 WO disclosed
EP-3770166-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2021-01-27 EP disclosed
US-20160075724-A1 CETP Inhibitors MERCK SHARP & DOHME (US) 2016-03-17 US disclosed
CN-104557757-A CETP inhibitors MERCK & CO INC 2015-04-29 CN disclosed
US-20140221383-A1 CETP INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-08-07 US disclosed
US-8735435-B2 CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2014-05-27 US disclosed
EP-1765793-B1 ANACETRAPIB AND OTHER CETP INHIBITPRS MERCK SHARP & DOHME (US) 2012-09-26 EP disclosed
EP-2415759-A1 CETP inhibitors Merck Sharp & Dohme Corporation (US) 2012-02-08 EP disclosed
US-20100099716-A1 CETP INHIBITORS MERCK SHARP & DOHME LLC 2010-04-22 US disclosed
US-7652049-B2 1-benzyl-4-[4'-fluoro-5'-isopropyl-2'-methoxy-4-(trifluoromethyl)biphenyl-2-yl]imidazolidin-2-one; cholesteryl ester transfer protein inhibitor; raising HDL-cholesterol, reducing LDL-cholesterol; atherosclerosis; antiinflammatory agent; synergistic mixture with other active ingredients MERCK & CO., INC. (US) 2010-01-26 US disclosed
US-20080119476-A1 Cetp Inhibitors ALI AMJAD 2008-05-22 US disclosed
EP-1765793-A1 CETP INHIBITORS Merck and Co., Inc. (US) 2007-03-28 EP disclosed
US-20060040999-A1 CETP inhibitors MERCK SHARP & DOHME LLC 2006-02-23 US disclosed
WO-2006014413-A1 CETP INHIBITORS MERCK & CO., INC. (US) 2006-02-09 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 (7 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-20140221383-A1 CETP INHIBITORS CETP, APOB, MTTP RAPGEF4 4288/4885AGBL2 377/4885CES2 78/4885
US-20060040999-A1 CETP inhibitors CETP, APOB, MTTP RAPGEF4 4288/4885AGBL2 377/4885CES2 78/4885
US-20240002374-A1 5-MEMBERED HETEROARYLAMINOSULFONAMIDES FOR TREATING CONDITIONS MEDIATED BY DEFICIENT CFTR ACTIVITY CFTR, PKD2, PKD1 RAPGEF4 1625/4885AGBL2 1708/4885CES2 983/4885
US-20080119476-A1 Cetp Inhibitors CETP, APOB, MTTP RAPGEF4 4288/4885AGBL2 377/4885CES2 78/4885
US-20230099293-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN RAPGEF4 4265/4885AGBL2 925/4885CES2 3521/4885
US-20100099716-A1 CETP INHIBITORS CETP, APOB, MTTP RAPGEF4 4288/4885AGBL2 377/4885CES2 78/4885
US-20160075724-A1 CETP Inhibitors CETP, APOB, MTTP RAPGEF4 4288/4885AGBL2 377/4885CES2 78/4885

“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.