SCHEMBL2203452

SCHEMBL2203452

CN(C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.48
DRD4 P21917 1/20 0.47
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HTR1A P08908 2/20 0.45
HTR1D P28221 2/20 0.45
HTR1B P28222 2/20 0.45
NPC1 O15118 2/20 0.45
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
TSHR P16473 1/20 0.43
ROCK1 Q13464 1/20 0.43
TP53 P04637 1/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 1/20 0.42
PLK1 P53350 1/20 0.42
ALDH1A1 P00352 1/20 0.41
AR P10275 1/20 0.41

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
SCHEMBL4426865 0.93 MAPT (0.55) DRD2L3MBTL1MAPTSMN1; SMN2NPC1
SCHEMBL15784402 0.91 DRD4 (0.57) DRD2L3MBTL1DRD4MAPTSMN1; SMN2
SCHEMBL8134006 0.85 DRD2 (0.58) DRD2L3MBTL1DRD4MAPTSMN1; SMN2
SCHEMBL7754766 0.84 DRD2 (0.55) DRD2L3MBTL1DRD4MAPTNPC1
SCHEMBL21712168 0.84 DRD2 (0.64) DRD2L3MBTL1DRD4MAPTSMN1; SMN2
SCHEMBL30912017 0.84 DRD2 (0.64) DRD2L3MBTL1DRD4MAPTSMN1; SMN2
SCHEMBL21712173 0.84 DRD2 (0.57) DRD2L3MBTL1DRD4MAPTSMN1; SMN2
SCHEMBL981641 0.82 NOTUM (0.60) DRD2MAPTSMN1; SMN2NPC1LMNA
SCHEMBL27872558 0.82 DRD2 (0.57) DRD2L3MBTL1DRD4MAPTSMN1; SMN2
SCHEMBL6966940 0.82 DRD2 (0.61) DRD2L3MBTL1DRD4MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250171431-A1 HETEROCYCLIC INHIBITORS OF IGF-1R FOR TREATMENT OF DISEASE HORIZON THERAPEUTICS IRELAND DAC (IE) 2025-05-29 US disclosed
WO-2025030163-A1 HETEROCYCLIC INHIBITORS OF IGF-1R FOR TREATMENT OF DISEASE HORIZON THERAPEUTICS IRELAND DAC (IE) 2025-02-06 WO disclosed
US-11939301-B2 5HT1F receptor agonists and mitochondrial biogenesis MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2024-03-26 US disclosed
US-20210238147-A1 5HT1F RECEPTOR AGONISTS AND MITOCHONDRIAL BIOGENESIS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT 2021-08-05 US disclosed
US-20210238147-A1 5HT1F RECEPTOR AGONISTS AND MITOCHONDRIAL BIOGENESIS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT 2021-08-05 US disclosed
US-11014892-B2 5HT1F receptor agonists and mitochondrial biogenesis MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2021-05-25 US disclosed
US-11014892-B2 5HT1F receptor agonists and mitochondrial biogenesis MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2021-05-25 US disclosed
US-20200055827-A1 5HT1F RECEPTOR AGONISTS AND MITOCHONDRIAL BIOGENESIS MEDICAL UNIVERSITY OF SOUTH CAROLINA 2020-02-20 US disclosed
US-20200055827-A1 5HT1F RECEPTOR AGONISTS AND MITOCHONDRIAL BIOGENESIS MEDICAL UNIVERSITY OF SOUTH CAROLINA 2020-02-20 US disclosed
EP-2188292-B1 2- [ (2-{PHENYLAMINO}-1H-PYRROLO [2, 3-D]PYRIMIDIN-4-YL) AMINO]BENZAMIDE DERIVATIVES AS IGF-1R INHIBITORS FOR THE TREATMENT OF CANCER GLAXOSMITHKLINE IP DEV LTD (GB) 2013-05-29 EP disclosed
US-7981903-B2 2-[2-{phenylamino}-1H-pyrrolo[2,3-D]pyrimidin-4-yl)amino] benzamide derivatives as IGF-1R inhibitors for the treatment of cancer GLAXOSMITHKLINE LLC (US) 2011-07-19 US disclosed
US-7981903-B2 2-[2-{phenylamino}-1H-pyrrolo[2,3-D]pyrimidin-4-yl)amino] benzamide derivatives as IGF-1R inhibitors for the treatment of cancer GLAXOSMITHKLINE LLC (US) 2011-07-19 US disclosed
US-7981903-B2 2-[2-{phenylamino}-1H-pyrrolo[2,3-D]pyrimidin-4-yl)amino] benzamide derivatives as IGF-1R inhibitors for the treatment of cancer GLAXOSMITHKLINE LLC (US) 2011-07-19 US disclosed
US-20100204196-A1 2-[2--1H-Pyrrolo[2,3-D]Pyrimidin-4-YL)Amino] Benzamide Derivatives As IGF-1R Inhibitors For The Treatment Of Cancer GLAXOSMITHKLINE LLC 2010-08-12 US disclosed
US-20100204196-A1 2-[2--1H-Pyrrolo[2,3-D]Pyrimidin-4-YL)Amino] Benzamide Derivatives As IGF-1R Inhibitors For The Treatment Of Cancer GLAXOSMITHKLINE LLC 2010-08-12 US disclosed
US-20100204196-A1 2-[2--1H-Pyrrolo[2,3-D]Pyrimidin-4-YL)Amino] Benzamide Derivatives As IGF-1R Inhibitors For The Treatment Of Cancer GLAXOSMITHKLINE LLC 2010-08-12 US disclosed
EP-2188292-A1 2- [ (2-{PHENYLAMINO}-1H-PYRROLO [2, 3-D]PYRIMIDIN-4-YL) AMINO]BENZAMIDE DERIVATIVES AS IGF-1R INHIBITORS FOR THE TREATMENT OF CANCER GlaxoSmithKline LLC (US) 2010-05-26 EP disclosed
WO-2010045451-A1 PYRROLOPYRIMIDINE COMPOUNDS GLAXOSMITHKLINE LLC (US) 2010-04-22 WO disclosed
WO-2009020990-A1 2- [ (2-{PHENYLAMINO}-1H-PYRROLO [2, 3-D] PYRIMIDIN-4-YL) AMINO] BENZAMIDE DERIVATIVES AS IGF-1R INHIBITORS FOR THE TREATMENT OF CANCER SMITHKLINE BEECHAM CORPORATION (US) 2009-02-12 WO disclosed
WO-2009020990-A1 2- [ (2-{PHENYLAMINO}-1H-PYRROLO [2, 3-D] PYRIMIDIN-4-YL) AMINO] BENZAMIDE DERIVATIVES AS IGF-1R INHIBITORS FOR THE TREATMENT OF CANCER SMITHKLINE BEECHAM CORPORATION (US) 2009-02-12 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-11939301-B2 5HT1F receptor agonists and mitochondrial biogenesis HTR1F, HTR1A, TFAM DRD2 338/4885L3MBTL1 2834/4885DRD4 739/4885
US-11014892-B2 5HT1F receptor agonists and mitochondrial biogenesis HTR1F, HTR1A, TFAM DRD2 338/4885L3MBTL1 2834/4885DRD4 739/4885
US-20200055827-A1 5HT1F RECEPTOR AGONISTS AND MITOCHONDRIAL BIOGENESIS HTR1F, HTR1A, TFAM DRD2 338/4885L3MBTL1 2834/4885DRD4 739/4885
US-20100204196-A1 2-[2--1H-Pyrrolo[2,3-D]Pyrimidin-4-YL)Amino] Benzamide Derivatives As IGF-1R Inhibitors For The Treatment Of Cancer IGF1R, IGFBP2, IGFBP1 DRD2 3618/4885L3MBTL1 4249/4885DRD4 4405/4885
US-20210238147-A1 5HT1F RECEPTOR AGONISTS AND MITOCHONDRIAL BIOGENESIS HTR1F, HTR1A, TFAM DRD2 338/4885L3MBTL1 2834/4885DRD4 739/4885
US-20250171431-A1 HETEROCYCLIC INHIBITORS OF IGF-1R FOR TREATMENT OF DISEASE IGF1R, TRHR, TSHR DRD2 3487/4885L3MBTL1 2633/4885DRD4 4165/4885

“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.