SCHEMBL336225

SCHEMBL336225

c1ccc(CN2CCNC3(CC3)C2)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.56
CYP2D6 P10635 3/20 0.54
TSHR P16473 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
HIF1A Q16665 1/20 0.51
CYP3A4 P08684 2/20 0.51
HSD17B10 Q99714 1/20 0.47
OPRL1 P41146 1/20 0.45
POLB P06746 1/20 0.44
MC4R P32245 1/20 0.43
GAA P10253 1/20 0.42
DRD4 P21917 1/20 0.42

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
SCHEMBL24802827 0.94 CYP2D6 (0.55) SIGMAR1CYP2D6TSHRMEN1KMT2A
SCHEMBL17608888 0.92 CYP2D6 (0.61) SIGMAR1CYP2D6TSHRMEN1KMT2A
SCHEMBL19320649 0.90 MC4R (0.53) SIGMAR1CYP2D6TSHRMEN1KMT2A
SCHEMBL10205914 0.86 CYP2D6 (0.61) SIGMAR1CYP2D6TSHRMEN1KMT2A
SCHEMBL14016361 0.86 CYP2D6 (0.58) SIGMAR1CYP2D6TSHRMEN1KMT2A
SCHEMBL1557055 0.84 CYP2D6 (0.53) SIGMAR1CYP2D6TSHRMEN1KMT2A
SCHEMBL30155309 0.84 SIGMAR1 (0.46) SIGMAR1CYP2D6TSHRMEN1KMT2A
SCHEMBL3399535 0.84 ALDH1A1 (0.49) SIGMAR1CYP2D6TSHRMEN1KMT2A
SCHEMBL25291191 0.80 CYP2D6 (0.51) SIGMAR1CYP2D6TSHRMEN1KMT2A
SCHEMBL3134881 0.80 SIGMAR1 (0.56) SIGMAR1CYP2D6TSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111943893-B Synthesis method of 4, 7-diazaspiro [2,5] octane compound 南京爱德程医药科技有限公司 2024-07-26 CN claimed
WO-2024154148-A1 PROCESS FOR PREPARATION OF RISDIPLAM, NOVEL INTERMEDIATES, AND PROCESS FOR PREPARATION THEREOF HARMAN FINOCHEM LIMITED (IN) 2024-07-25 WO claimed
CN-111943893-B Synthesis method of 4, 7-diazaspiro [2,5] octane compound 南京爱德程医药科技有限公司 2024-07-26 CN disclosed
CN-111943893-B Synthesis method of 4, 7-diazaspiro [2,5] octane compound 南京爱德程医药科技有限公司 2024-07-26 CN disclosed
WO-2024154148-A1 PROCESS FOR PREPARATION OF RISDIPLAM, NOVEL INTERMEDIATES, AND PROCESS FOR PREPARATION THEREOF HARMAN FINOCHEM LIMITED (IN) 2024-07-25 WO disclosed
CN-112384509-B Furin inhibitors 葛兰素史密斯克莱知识产权发展有限公司 2024-04-30 CN disclosed
EP-3790871-B1 FURIN INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2024-01-24 EP disclosed
EP-3790871-B1 FURIN INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2024-01-24 EP disclosed
US-11773078-B2 Furin inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-03 US disclosed
US-11773078-B2 Furin inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-03 US disclosed
US-11773078-B2 Furin inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-03 US disclosed
US-8097622-B2 Morpholinopurine derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-01-17 US disclosed
EP-2380892-A1 IMIDAZOTHIAZOLE DERIVATIVE HAVING PROLINE RING STRUCTURE Daiichi Sankyo Company, Limited (JP) 2011-10-26 EP disclosed
EP-2336132-A1 MORPHOLINOPURINE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2011-06-22 EP disclosed
EP-2336132-A1 MORPHOLINOPURINE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2011-06-22 EP disclosed
WO-2010082612-A1 IMIDAZOTHIAZOLE DERIVATIVE HAVING PROLINE RING STRUCTURE 第一三共株式会社 (JP) 2010-07-22 WO disclosed
US-20100130492-A1 MORPHOLINOPURINE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-05-27 US disclosed
US-20100130492-A1 MORPHOLINOPURINE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-05-27 US disclosed
US-20100130492-A1 MORPHOLINOPURINE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-05-27 US disclosed
WO-2010044401-A1 MORPHOLINOPURINE DERIVATIVE 第一三共株式会社 (JP) 2010-04-22 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 (2 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-11773078-B2 Furin inhibitors FURIN, TGFB1, PCSK7 SIGMAR1 4873/4885CYP2D6 2965/4885TSHR 3953/4885
US-20100130492-A1 MORPHOLINOPURINE DERIVATIVES MTOR, RICTOR, PIK3R1 SIGMAR1 2357/4885CYP2D6 2625/4885TSHR 2037/4885

“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.