SCHEMBL790377

SCHEMBL790377

[C]1CCc2ncccc2C1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.36
DRD3 P35462 1/20 0.36
GRIN1 Q05586 4/20 0.33
GRIN2B Q13224 4/20 0.33
HDAC6 Q9UBN7 1/20 0.31
S100A4 P26447 1/20 0.31
CDC25B P30305 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
SCHEMBL1450582 0.84 GRIN1 (0.33) DRD2DRD3GRIN1GRIN2B
SCHEMBL6401111 0.81
SCHEMBL1450556 0.77 TSHR (0.33) DRD2DRD3GRIN1GRIN2B
SCHEMBL8348677 0.73
SCHEMBL17413659 0.73 DRD2 (0.42) DRD2DRD3GRIN1GRIN2B
Bromide SCHEMBL8777272 0.72 DRD2 (0.41) DRD2DRD3GRIN1GRIN2B
Hydrochloric Acid SCHEMBL8777224 0.72 DRD2 (0.41) DRD2DRD3GRIN1GRIN2B
SCHEMBL7424121 0.71
SCHEMBL29395766 0.70
SCHEMBL149347 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240116910-A1 Heterocycles as WIP1 Inhibitors PMV PHARMACEUTICALS, INC. 2024-04-11 US claimed
WO-2024129931-A1 ALPHA-V BETA-6(ανβ6) INTEGRIN LIGANDS FOR EXTRAHEPATIC DELIVERY ALNYLAM PHARMACEUTICALS, INC. (US) 2024-06-20 WO disclosed
US-20240182473-A1 COMPOUNDS USEFUL IN HIV THERAPY GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2024-06-06 US disclosed
WO-2024096067-A1 CYCLIC PEPTIDE DERIVATIVE COMPOSITION FOR TREATING OR PREVENTING NEUROPATHIC PAIN AND/OR INFLAMMATORY PAIN 第一工業製薬株式会社 2024-05-10 WO disclosed
WO-2024096066-A1 CYCLIC PEPTIDE DERIVATIVE COMPOSITION FOR TREATING OR PREVENTING CENTRAL NERVOUS SYSTEM INJURY/DISEASE 第一工業製薬株式会社 2024-05-10 WO disclosed
EP-4365182-A1 GEMCITABINE ANTICANCER DERIVATIVE AND ANTICANCER PHARMACEUTICAL USE Ascentawits Pharmaceuticals, Ltd. (CN) 2024-05-08 EP disclosed
US-20240140970-A1 A DEUTERATED COMPOUND, AND PREPARATION METHOD AND USE THEREOF ASCENTAWITS PHARMACEUTICALS LTD (CN) 2024-05-02 US disclosed
CN-117941786-A Functional beverage and preparation method thereof 武汉市中心医院 2024-04-30 CN disclosed
CN-117956998-A Cancer patients treated for KRAS mutations 深圳艾欣达伟医药科技有限公司 2024-04-30 CN disclosed
CN-117918483-A Red rice fermented black rice flour and preparation method and application thereof 武汉市中心医院 2024-04-26 CN disclosed
WO-2009029729-A1 AMINO TRICYCLIC-NUCLEOSIDE COMPOUNDS, COMPOSITIONS, AND METHODS OF USE GENELABS TECHNOLOGIES, INC. (US) 2009-03-05 WO disclosed
US-20090054475-A1 treatment of Type II diabetes and other diseases associated with poor glycemic control METABOLEX, INC. (US) 2009-02-26 US disclosed
WO-2009023179-A2 NITROGEN CONTAINING BICYCLIC CHEMICAL ENTITIES FOR TREATING VIRAL INFECTIONS GENELABS TECHNOLOGIES, INC. (US) 2009-02-19 WO disclosed
WO-2009014910-A2 N-AZACYCLIC SUBSTITUTED PYRROLE, PYRAZOLE, IMIDAZOLE, TRIAZOLE AND TETRAZOLE DERIVATIVES AS AGONISTS OF THE RUP3 OR GPR119 RECEPTOR FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS METABOLEX, INC. (US) 2009-01-29 WO disclosed
WO-2009011787-A1 ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE GENELABS TECHNOLOGIES, INC. (US) 2009-01-22 WO disclosed
WO-2009009768-A2 METHODS OF INHIBITING THE FORMATION OF AMYLOID-β DIFFUSABLE LIGANDS USING A ACYLHYDRAZIDE COMPOUDS ACUMEN PHARMACEUTICALS, INC. (US) 2009-01-15 WO disclosed
WO-2008154601-A1 ANTI-VIRAL INHIBITORS AND METHODS OF USE GENELABS TECHNOLOGIES, INC. (US) 2008-12-18 WO disclosed
WO-2008128984-A1 AMINOPYRIMIDINE DERIVATIVES AS GLUTAMINYL CYCLASE INHIBITORS PROBIODRUG AG (DE) 2008-10-30 WO disclosed
US-20080260688-A1 NOVEL INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2008-10-23 US disclosed
WO-2008083238-A2 HETEROCYCLIC RECEPTOR AGONISTS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS METABOLEX INC. (US) 2008-07-10 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-20080260688-A1 NOVEL INHIBITORS OF GLUTAMINYL CYCLASE GLS, GLS2, QPCT DRD2 3357/4885DRD3 3454/4885GRIN1 178/4885
US-20240182473-A1 COMPOUNDS USEFUL IN HIV THERAPY CD4, CCR5, G6PD DRD2 3154/4885DRD3 2680/4885GRIN1 2811/4885
US-20240140970-A1 A DEUTERATED COMPOUND, AND PREPARATION METHOD AND USE THEREOF DMPK, DEK, DOHH DRD2 874/4885DRD3 853/4885GRIN1 4150/4885
US-20090054475-A1 treatment of Type II diabetes and other diseases associated with poor glycemic control SLC5A2, IAPP, GPR119 DRD2 3391/4885DRD3 4092/4885GRIN1 4319/4885
US-20240116910-A1 Heterocycles as WIP1 Inhibitors WAPL, WHR1, G3BP1 DRD2 4403/4885DRD3 4073/4885GRIN1 4018/4885

“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.