SCHEMBL3674968

SCHEMBL3674968

COC(=O)CCn1cc(B2OC(C)(C)C(C)(C)O2)cn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.54
DGAT1 O75907 1/20 0.40
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
UCHL1 P09936 1/20 0.35
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
LMNA P02545 2/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GAA P10253 2/20 0.32
LIPG Q9Y5X9 1/20 0.32
KAT2B Q92831 2/20 0.32
JAK1 P23458 1/20 0.32
PDK2 Q15119 1/20 0.31
HIF1A Q16665 1/20 0.31
KMT2A Q03164 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL22491112 0.92 FFAR1 (0.52) FFAR1DGAT1GSK3AGSK3BUCHL1
SCHEMBL25258123 0.90 FFAR1 (0.50) FFAR1DGAT1GSK3AGSK3BUCHL1
SCHEMBL15298112 0.87 FFAR1 (0.52) FFAR1DGAT1GSK3AGSK3BUCHL1
SCHEMBL4099087 0.86 FFAR1 (0.57) FFAR1DGAT1GSK3AGSK3BUCHL1
SCHEMBL1725558 0.86 FFAR1 (0.57) FFAR1DGAT1GSK3AGSK3BUCHL1
SCHEMBL2483324 0.85 FFAR1 (0.58) FFAR1DGAT1GSK3AGSK3BUCHL1
SCHEMBL2993758 0.84 FFAR1 (0.57) FFAR1DGAT1GSK3AGSK3BUCHL1
SCHEMBL22092673 0.82 FFAR1 (0.52) FFAR1DGAT1GSK3AGSK3BUCHL1
SCHEMBL31313005 0.82 FFAR1 (0.54) FFAR1DGAT1GSK3AGSK3BUCHL1
SCHEMBL1712623 0.80 FFAR1 (0.50) FFAR1UCHL1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230055250-A1 MAP4K4 INHIBITORS IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) 2023-02-23 US disclosed
US-20220017483-A1 AMINOPYRIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF SICHUAN-KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD (CN) 2022-01-20 US disclosed
EP-3904348-A1 AMINOPYRIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) 2021-11-03 EP disclosed
WO-2020115481-A1 MAP4K4 INHIBITORS IMPERIAL COLLEGE OF SCIENCE, TECHNOLOGY AND MEDICINE (GB) 2020-06-11 WO disclosed
US-9533977-B2 Oxazolidinone derivative as CETP inhibitor, its preparation method, and pharmaceutical composition comprising the same DONG-A ST CO., LTD. (KR) 2017-01-03 US disclosed
US-20160039804-A1 NOVEL OXAZOLIDINONE DERIVATIVE AS CETP INHIBITOR, ITS PREPARATION METHOD, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME DONG-A ST CO., LTD. (KR) 2016-02-11 US disclosed
EP-2978761-A1 NOVEL OXAZOLIDINONE DERIVATIVE AS CETP INHIBITOR, ITS PREPARATION METHOD, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Dong-A ST Co., Ltd. (KR) 2016-02-03 EP disclosed
US-9163007-B2 5-substituted indazoles as kinase inhibitors ABBVIE INC. (US) 2015-10-20 US disclosed
US-20140343066-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS AbbVie Deutschland GmbH & Co. KG (DE) 2014-11-20 US disclosed
WO-2014157994-A1 NOVEL OXAZOLIDINONE DERIVATIVE AS CETP INHIBITOR, ITS PREPARATION METHOD, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME DONG-A ST CO.,LTD (KR) 2014-10-02 WO disclosed
US-8648069-B2 5-substituted indazoles as kinase inhibitors ABBVIE INC. (US) 2014-02-11 US disclosed
EP-2167491-A1 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS Abbott Laboratories (US) 2010-03-31 EP disclosed
US-20090203690-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2009-08-13 US disclosed
WO-2008154241-A1 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2008-12-18 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 (5 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-20140343066-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS GSK3B, GSK3A, PIM3 FFAR1 4566/4885DGAT1 4397/4885GSK3A 2/4885
US-20230055250-A1 MAP4K4 INHIBITORS MAP4K4, MAP4K5, MAP4K1 FFAR1 2666/4885DGAT1 2035/4885GSK3A 308/4885
US-20090203690-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS GSK3B, GSK3A, PIM3 FFAR1 4566/4885DGAT1 4397/4885GSK3A 2/4885
US-20160039804-A1 NOVEL OXAZOLIDINONE DERIVATIVE AS CETP INHIBITOR, ITS PREPARATION METHOD, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CETP, MTTP, APOB FFAR1 1890/4885DGAT1 270/4885GSK3A 553/4885
US-20220017483-A1 AMINOPYRIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF ADORA1, ADORA2A, ADORA2B FFAR1 46/4885DGAT1 4089/4885GSK3A 1759/4885

“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.