SCHEMBL3905087

SCHEMBL3905087

CC(C)(C)OC(=O)N1CCc2cc(OCc3ccccc3)ccc21

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.54
PDK2 Q15119 1/20 0.54
PDK3 Q15120 1/20 0.54
PDK4 Q16654 1/20 0.54
GHSR Q92847 6/20 0.54
HRH3 Q9Y5N1 5/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ROCK2 O75116 1/20 0.52
SRD5A1 P18405 1/20 0.50
DHODH Q02127 1/20 0.46
YAP1 P46937 1/20 0.46
GPR119 Q8TDV5 1/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
NOTUM Q6P988 1/20 0.45
CYP2D6 P10635 1/20 0.45

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
SCHEMBL30102438 1.00 PDK1 (0.54) PDK1PDK2PDK3PDK4GHSR
SCHEMBL3902299 0.96 PDK1 (0.51) PDK1PDK2PDK3PDK4GHSR
SCHEMBL3903665 0.94 GHSR (0.49) PDK1PDK2PDK3PDK4GHSR
SCHEMBL3903564 0.92 NPC1 (0.48) PDK1PDK2PDK3PDK4GHSR
SCHEMBL17321358 0.91 HRH3 (0.53) PDK1PDK2PDK3PDK4GHSR
SCHEMBL3905150 0.88 GHSR (0.45) PDK1PDK2PDK3PDK4GHSR
SCHEMBL13957119 0.86 DHODH (0.45) PDK1PDK2PDK3PDK4GHSR
SCHEMBL3907882 0.85 TACR1 (0.48) GHSRSRD5A1DHODHGPR119MAOA
SCHEMBL3902842 0.84 PTPN1 (0.47) PDK1PDK2PDK3PDK4GHSR
SCHEMBL3912242 0.84 POLB (0.43) PDK1PDK2PDK3PDK4GHSR

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
US-12391666-B2 Indoline-1-formamide compound, preparation method therefor, and medical use thereof BEIJING INNOCARE PHARMA TECH CO., LTD. (CN) 2025-08-19 US disclosed
CN-112384506-B Indoline-1-formamide compound, preparation method and application thereof in medicine and pharmacology 北京诺诚健华医药科技有限公司 2023-01-24 CN disclosed
US-20210188806-A1 INDOLINE-1-FORMAMIDE COMPOUND, PREPARATION METHOD THEREFOR, AND MEDICAL USE THEREOF BEIJING INNOCARE PHARMA TECH CO., LTD. (CN) 2021-06-24 US disclosed
US-20210188806-A1 INDOLINE-1-FORMAMIDE COMPOUND, PREPARATION METHOD THEREFOR, AND MEDICAL USE THEREOF BEIJING INNOCARE PHARMA TECH CO., LTD. (CN) 2021-06-24 US disclosed
EP-3795567-A1 INDOLINE-1-FORMAMIDE COMPOUND, PREPARATION METHOD THEREFOR, AND MEDICAL USE THEREOF Beijing InnoCare Pharma Tech Co., Ltd. (CN) 2021-03-24 EP disclosed
CN-112384506-A Indoline-1-formamide compound, preparation method and application thereof in medicine and pharmacology 北京诺诚健华医药科技有限公司 2021-02-19 CN disclosed
CN-110483482-A Indoline -1- Carbox amide, preparation method and its in application pharmaceutically BEIJING INNOCARE PHARMA TECH CO LTD 2019-11-22 CN disclosed
US-20090324581-A1 HETEROARYLAMIDE LOWER CARBOXYLIC ACID DERIVATIVE DAIICHI SANKYO COMPANY LIMITED (JP) 2009-12-31 US disclosed
US-20090324581-A1 HETEROARYLAMIDE LOWER CARBOXYLIC ACID DERIVATIVE DAIICHI SANKYO COMPANY LIMITED (JP) 2009-12-31 US disclosed
US-20090324581-A1 HETEROARYLAMIDE LOWER CARBOXYLIC ACID DERIVATIVE DAIICHI SANKYO COMPANY LIMITED (JP) 2009-12-31 US disclosed
US-7102007-B2 Dihydroindole and tetrahydroquinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2006-09-05 US disclosed
EP-1349833-B1 INDOLE AND DIHYDROINDOLE DERIVATIVES HOFFMANN LA ROCHE (CH) 2006-04-19 EP disclosed
EP-1358162-B1 DIHYDROINDOLE AND TETRAHYDROQUINOLINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2006-02-08 EP disclosed
US-20050020624-A1 Dihydroindole and tetrahydroquinoline derivatives AEBI JOHANNES (CH) 2005-01-27 US disclosed
US-6706751-B2 ANTICHOLESTEROL AGENTS; CARDIOVASCULAR DISORDERS; ANTIDIABETIC AGENTS; ANTIPROLIFERATIVE AGENTS HOFFMAN-LA ROCHE INC. 2004-03-16 US disclosed
EP-1358162-A1 DIHYDROINDOLE AND TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-11-05 EP disclosed
US-6503907-B2 Indole derivatives or dihydroindole derivatives or salts are useful for the treatment of diseases associated with 2,3-oxidosqualene-lanosterol cyclase such as gallstone, tumorhypercholesterolemia, hyperlipemia, arterioscerosis etc. HOFFMANN-LA ROCHE INC. 2003-01-07 US disclosed
US-20030004156-A1 Dihydroindole and tetrahydroquinoline derivatives F. HOFFMANN-LA ROCHE AG (CH) 2003-01-02 US disclosed
US-20020103247-A1 Indole derivatives or dihydroindole derivatives or salts are useful for the treatment of diseases associated with 2,3-oxidosqualene-lanosterol cyclase such as gallstone, tumorhypercholesterolemia, hyperlipemia, arterioscerosis etc. HOFFMANN-LA ROCHE INC. 2002-08-01 US disclosed
WO-2002050041-A1 DIHYDROINDOLE AND TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-06-27 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 (6 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-12391666-B2 Indoline-1-formamide compound, preparation method therefor, and medical use thereof FLT1, KDR, TEK PDK1 775/4885PDK2 1092/4885PDK3 2053/4885
US-20050020624-A1 Dihydroindole and tetrahydroquinoline derivatives CYP46A1, LSS, CYP51A1 PDK1 484/4885PDK2 273/4885PDK3 496/4885
US-20090324581-A1 HETEROARYLAMIDE LOWER CARBOXYLIC ACID DERIVATIVE S1PR3, S1PR2, S1PR1 PDK1 1385/4885PDK2 1823/4885PDK3 1874/4885
US-20030004156-A1 Dihydroindole and tetrahydroquinoline derivatives CYP46A1, LSS, CYP51A1 PDK1 484/4885PDK2 273/4885PDK3 496/4885
US-20020103247-A1 Indole derivatives or dihydroindole derivatives or salts are useful for the treatment of diseases associated with 2,3-oxidosqualene-lanosterol cyclase such as gallstone, tumorhypercholesterolemia, hyperlipemia, arterioscerosis etc. LSS, CYP51A1, DHCR7 PDK1 701/4885PDK2 670/4885PDK3 973/4885
US-20210188806-A1 INDOLINE-1-FORMAMIDE COMPOUND, PREPARATION METHOD THEREFOR, AND MEDICAL USE THEREOF FLT1, KDR, TEK PDK1 775/4885PDK2 1092/4885PDK3 2053/4885

“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.