SCHEMBL6424327

SCHEMBL6424327

Cc1cc2c(s1)CCNC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PNMT P11086 10/20 1.00
CD44 P16070 1/20 0.38
MAOB P27338 1/20 0.38
TPSAB1 Q15661 1/20 0.36
TPSD1 Q9BZJ3 1/20 0.36
TPSG1 Q9NRR2 1/20 0.36
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
ASIC3 Q9UHC3 1/20 0.36
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C19 P33261 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL12563256 0.89 PNMT (0.79) PNMTMEN1TSHRCYP2C19RAB9A
SCHEMBL13560077 0.86 PNMT (0.75) PNMTMEN1TSHRCYP2C19RAB9A
Trifluoroacetic Acid SCHEMBL17965628 0.84 PNMT (0.71) PNMTTPSAB1TPSD1TPSG1
SCHEMBL4709086 0.84 PNMT (0.72) PNMTCD44MAOBADRA2AADRA2B
SCHEMBL23491280 0.81
SCHEMBL21236155 0.78 PNMT (0.63) PNMTCD44MAOBTPSAB1TPSD1
SCHEMBL12563262 0.77 PNMT (0.62) PNMTMEN1TSHRCYP2C19RAB9A
SCHEMBL1427612 0.76 PNMT (0.61) PNMTCD44MAOBTPSAB1TPSD1
SCHEMBL17613134 0.76 PNMT (0.61) PNMTCD44MAOBTPSAB1TPSD1
SCHEMBL12126395 0.76 PNMT (0.61) PNMTCD44MAOBTPSAB1TPSD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024071398-A1 ABHD6 ANTAGONIST 小野薬品工業株式会社 2024-04-04 WO disclosed
WO-2024017977-A1 IMIDAZOPYRIDINE COMPOUNDS, PREPARATION THEREOF AND THERAPEUTIC USES THEREOF SANOFI (FR) 2024-01-25 WO disclosed
WO-2023116812-A1 SULFONYLUREA COMPOUND 瑞石生物医药有限公司 2023-06-29 WO disclosed
CN-113387959-B Synthesis method of thieno [3,2-c ] pyridine-6-carboxylic acid methyl ester 烟台理工学院 2023-05-05 CN disclosed
US-11572356-B2 Biaryl inhibitors of Bruton's tyrosine kinase BIOGEN MA INC. (US) 2023-02-07 US disclosed
EP-3887372-B1 FURTHER HETEROAROMATIC COMPOUNDS HAVING ACTIVITY AGAINST RSV JANSSEN SCIENCES IRELAND UNLIMITED CO (IE) 2022-10-12 EP disclosed
WO-2021113686-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION (US) 2021-06-10 WO disclosed
EP-3484879-B1 HYDROXYQUINOLINONE COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY CHIESI FARM SPA (IT) 2020-12-30 EP disclosed
WO-2019192506-A1 IMMUNOMODULATORS, COMPOSITIONS AND METHODS THEREOF BETTA PHARMACEUTICALS CO., LTD (CN) 2019-10-10 WO disclosed
EP-3524602-A1 PYRIDO FIVE-ELEMENT AROMATIC RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Haihe Pharmaceutical Co., Ltd. (CN) 2019-08-14 EP disclosed
US-20100063023-A1 Bicyclic and Tricyclic Substituted 6-Methylidene Carbapenems as Broad Spectrum Beta-Lactamase Inhibitors WYETH (US) 2010-03-11 US disclosed
US-20070185077-A1 Methods of treating, preventing and inhibiting cancer metastasis and tumor formation WASHINGTON UNIVERSITY 2007-08-09 US disclosed
US-20070185077-A1 Methods of treating, preventing and inhibiting cancer metastasis and tumor formation WASHINGTON UNIVERSITY 2007-08-09 US disclosed
WO-2005044978-A9 METHODS OF TREATING, PREVENTING AND INHIBITING CANCER METASTASIS AND TUMOR FORMATION UNIV WASHINGTON (US) 2005-11-03 WO disclosed
WO-2005044978-A2 METHODS OF TREATING, PREVENTING AND INHIBITING CANCER METASTASIS AND TUMOR FORMATION WASHINGTON UNIVERSITY (US) 2005-05-19 WO disclosed
EP-1057814-B1 TETRAHYDROBENZINDOLE DERIVATIVES MEIJI SEIKA KAISHA (JP) 2005-03-09 EP disclosed
US-6498251-B1 Tetrahydrobenzindole derivatives MEIJI SEIKA KAISHA, LTD. (JP) 2002-12-24 US disclosed
US-6407112-B1 2A,3,4,5-TETRAHYDRO-1H-BENZ(CD)INDOL-2-ONE DERIVATIVES; 5-HYDROXYTRYPTAMINE AGONISTS; SLEEP, CIRCADIAN RHYTHYM, BIPOLAR, AND PSYCHOLOGICAL DISORDER TREATMENT MEIJI SEIKA KAISHA, LTD. (JP) 2002-06-18 US disclosed
EP-1081136-A1 OPTICALLY ACTIVE TETRAHYDROBENZINDOLE DERIVATIVES Meiji Seika Kaisha, Ltd. (JP) 2001-03-07 EP disclosed
EP-1057814-A1 TETRAHYDROBENZINDOLE DERIVATIVES Meiji Seika Kaisha, Ltd. (JP) 2000-12-06 EP 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 (3 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-11572356-B2 Biaryl inhibitors of Bruton's tyrosine kinase ABL1, BTK, LYN PNMT 2859/4885CD44 4569/4885MAOB 1005/4885
US-20070185077-A1 Methods of treating, preventing and inhibiting cancer metastasis and tumor formation ITGB3, ITGB1, ITGA2B PNMT 3600/4885CD44 227/4885MAOB 2302/4885
US-20100063023-A1 Bicyclic and Tricyclic Substituted 6-Methylidene Carbapenems as Broad Spectrum Beta-Lactamase Inhibitors MGAM, CYP2C18, BCAT2 PNMT 1278/4885CD44 3883/4885MAOB 240/4885

“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.