SCHEMBL10053019

SCHEMBL10053019

CC(C)OC(=O)N1CCN(C)CC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
HTR1A P08908 1/20 0.44
TP53 P04637 1/20 0.40
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
TLR2 O60603 3/20 0.39
CYP2C19 P33261 1/20 0.39
HSD17B10 Q99714 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
TSHR P16473 1/20 0.37
GPR119 Q8TDV5 1/20 0.37
NPC1 O15118 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
SCHEMBL27979621 0.91
SCHEMBL26317513 0.91 TSHR (0.43) CYP1A2HRH2HRH1ALDH1A1TSHR
SCHEMBL10621821 0.85 CYP1A2 (0.46) CYP1A2TDP1HTR1ATP53CYP2C19
SCHEMBL21428422 0.83 CYP1A2 (0.45) CYP1A2TDP1HTR1ATP53CYP2C19
Hydrochloric Acid SCHEMBL15254285 0.83 CYP1A2 (0.45) CYP1A2TDP1HTR1ACYP2C19HSD17B10
SCHEMBL12184259 0.83 PIK3CD (0.48) CYP1A2TDP1HRH2HRH1KDM4E
SCHEMBL5412873 0.82 ALDH1A1 (0.42) CYP1A2ALDH1A1TSHRGPR119NPC1
SCHEMBL2654623 0.82 TSHR (0.40) CYP1A2HRH2HRH1ALDH1A1TSHR
SCHEMBL24715746 0.81 GPR119 (0.36) CYP1A2HRH2HRH1ALDH1A1TSHR
SCHEMBL17244903 0.81 HRH3 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4389223-A1 SYNTHESIS, PHARMACOLOGY AND USE OF NEW WATER-SOLUBLE AND SELECTIVE FMS-LIKE TYROSINE KINASE 3 (FLT3) INHIBITORS Universität Regensburg (DE) 2024-06-26 EP disclosed
US-20230382913-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF ORGANOVO, INC. 2023-11-30 US disclosed
US-20230302142-A1 Cytotoxic Agents Pheon Therapeutics Ltd. (GB) 2023-09-28 US disclosed
US-11691972-B2 Compounds for targeted degradation of BRD9 C4 THERAPEUTICS, INC. (US) 2023-07-04 US disclosed
WO-2023001905-A1 NOVEL ANTIFUNGAL COMPOUNDS SELMOD GMBH (CH) 2023-01-26 WO disclosed
CN-114763342-A Synthesis method of high-purity 4-methylpiperazine-1-formic ether 江苏天士力帝益药业有限公司 2022-07-19 CN disclosed
WO-2022023735-A1 CYTOTOXIC AGENTS FEMTOGENIX LIMITED (GB) 2022-02-03 WO disclosed
US-20210380605-A1 PYRROLOBENZODIAZEPINE CONJUGATES MEDIMMUNE LIMITED (GB) 2021-12-09 US disclosed
CN-113552241-A Method for determining residual content of 4-methylpiperazine-1-formate genotoxic impurities in zopiclone 江苏天士力帝益药业有限公司 2021-10-26 CN disclosed
US-20210316006-A1 PYRROLOBENZODIAZEPINE CONJUGATES MEDIMMUNE LIMITED (GB) 2021-10-14 US disclosed
US-20100009954-A1 BETA-LACTAMASE INHIBITORY COMPOUNDS SOUTHERN METHODIST UNIVERSITY 2010-01-14 US disclosed
US-7491724-B2 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION (US) 2009-02-17 US disclosed
US-20090029939-A1 Pre-organized tricyclic integrase inhibitor compounds GILEAD SCIENCES, INC. 2009-01-29 US disclosed
US-20080214572-A1 Selected Tetracyclic Tetrahydrofuran Derivatives Containing a Cyclic Amine Side Chain FERNANDEZ-GADEA FRANCISCO JAVIER 2008-09-04 US disclosed
US-20080167288-A1 Substituted cyclic hydroxamates as lnhibitors of matrix metalloproteinases LNCYTE CORPORATION (US) 2008-07-10 US disclosed
US-20070191469-A1 Novel tetracyclic tetrahydrofuran derivatives JANSSEN-CILAG S.A. (ES) 2007-08-16 US disclosed
US-20070191469-A1 Novel tetracyclic tetrahydrofuran derivatives JANSSEN-CILAG S.A. (ES) 2007-08-16 US disclosed
US-7253180-B2 Pre-organized tricyclic integrase inhibitor compounds GILEAD SCIENCES, INC. (US) 2007-08-07 US disclosed
CN-1136191-C Carboxy substituted carboxamide derivatives as tachykinin receptor antagonists ������ҩ�����޹�˾ 2004-01-28 CN disclosed
CN-1301253-A Carboxy substituted carboxamide derivatives as tachykinin receptor antagonists AVENTIS PHARMACEUTICAL INC (US) 2001-06-27 CN 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 (10 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-20090029939-A1 Pre-organized tricyclic integrase inhibitor compounds MUS81, CDKL4, INTS6 CYP1A2 330/4885TDP1 537/4885HTR1A 930/4885
US-20070191469-A1 Novel tetracyclic tetrahydrofuran derivatives HTR2C, HTR2A, HTR1A CYP1A2 118/4885TDP1 2025/4885HTR1A 3/4885
US-20080214572-A1 Selected Tetracyclic Tetrahydrofuran Derivatives Containing a Cyclic Amine Side Chain HTR2C, HTR2A, HTR5A CYP1A2 364/4885TDP1 2822/4885HTR1A 6/4885
US-20210316006-A1 PYRROLOBENZODIAZEPINE CONJUGATES BCR, MCL1, CD79B CYP1A2 1243/4885TDP1 2182/4885HTR1A 982/4885
US-20230382913-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF NR1H4, NR1H2, NR1H3 CYP1A2 494/4885TDP1 3839/4885HTR1A 2683/4885
US-20230302142-A1 Cytotoxic Agents ANXA11, ANXA5, HAX1 CYP1A2 3344/4885TDP1 823/4885HTR1A 1026/4885
US-20080167288-A1 Substituted cyclic hydroxamates as lnhibitors of matrix metalloproteinases MMP25, MMP9, MMP24 CYP1A2 635/4885TDP1 1870/4885HTR1A 2213/4885
US-11691972-B2 Compounds for targeted degradation of BRD9 BRD9, BRD1, BRWD1 CYP1A2 4742/4885TDP1 2141/4885HTR1A 4388/4885
US-20210380605-A1 PYRROLOBENZODIAZEPINE CONJUGATES PRLHR, GLRA1, CXCR1 CYP1A2 1902/4885TDP1 1310/4885HTR1A 457/4885
US-20100009954-A1 BETA-LACTAMASE INHIBITORY COMPOUNDS MGAM, GUSB, LCT CYP1A2 878/4885TDP1 2446/4885HTR1A 4628/4885

“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.