SCHEMBL2625799

SCHEMBL2625799

CN1CCc2ccc(F)cc2C1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.55
MAOB P27338 4/20 0.55
SLC6A4 P31645 3/20 0.52
DRD1 P21728 2/20 0.46
DRD5 P21918 2/20 0.46
DRD2 P14416 2/20 0.45
DRD3 P35462 2/20 0.45
DRD4 P21917 1/20 0.45
NOTUM Q6P988 1/20 0.45
HTR7 P34969 2/20 0.44
HTR1A P08908 1/20 0.44
HTR2A P28223 1/20 0.44
HTR2B P41595 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
ALDH1A1 P00352 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL12363785 0.94 MAOA (0.59) MAOAMAOBSLC6A4DRD1DRD5
SCHEMBL1903261 0.92 DRD1 (0.50) MAOAMAOBSLC6A4DRD1DRD5
SCHEMBL8228638 0.85 DPP9 (0.47) MAOAMAOBSLC6A4SLC6A2SLC6A3
SCHEMBL13068138 0.78 KMT2A (0.41) MAOBSLC6A4DRD2DRD3NOTUM
SCHEMBL12965828 0.78 MAOA (0.69) MAOAMAOBSLC6A4DRD1DRD5
SCHEMBL19700145 0.78 KCNH2 (0.50) MAOBSLC6A4DRD2DRD3NOTUM
SCHEMBL6370169 0.78 HTR7 (0.51) SLC6A4DRD1DRD2DRD3HTR7
SCHEMBL9963386 0.78 KCNH2 (0.50) SLC6A4DRD2DRD3NOTUMHTR7
SCHEMBL8244793 0.78 MAOA (0.57) MAOAMAOBSLC6A4DRD1DRD5
SCHEMBL13875036 0.76 MAOA (0.55) MAOAMAOBSLC6A4DRD1DRD5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230346764-A1 Methods and Compositions for Treating Pruritus, Xerosis, and Associated Disease Using CCR3-Inhibitors ALKAHEST, INC. 2023-11-02 US disclosed
US-20230339902-A1 TRICYCLIC LIGANDS FOR DEGRADATION OF IKZF2 OR IKZF4 C4 THERAPEUTICS, INC. (US) 2023-10-26 US disclosed
US-10669274-B2 Azaphenalene-3-one derivative, preparation method therefor, and application therof SUZHOU KANGRUN PHARMACEUTICALS INC. (CN) 2020-06-02 US disclosed
US-20200031828-A1 AZAPHENALENE-3-ONE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATION THEROF SUZHOU KANGRUN PHARMACEUTICALS INC. (CN) 2020-01-30 US disclosed
WO-2019118657-A1 FLUORINATED 4-(SUBSTITUTED AMINO)PHENYL CARBAMATE DERIVATIVES SCIFLUOR LIFE SCIENCES, INC. (US) 2019-06-20 WO disclosed
EP-2731608-B1 INHIBITORS OF BACTERIAL TYPE III SECRETION SYSTEM MICROBIOTIX INC (US) 2018-03-14 EP disclosed
US-20170355679-A1 FLUORINATED 2-AMINO-4-(SUBSTITUTED AMINO)PHENYL CARBAMATE DERIVATIVES SCIFLUOR LIFE SCIENCES, INC. 2017-12-14 US disclosed
US-8877745-B2 CCR2 receptor antagonists, method for producing the same, and use thereof as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-11-04 US disclosed
US-8829006-B2 Compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-09-09 US disclosed
US-8653075-B2 Therapeutic methods employing substituted piperidines which are CCR3 antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-02-18 US disclosed
US-20100144701-A1 Modulators of CB1 Receptors 7TM PHARMA A/S (DK) 2010-06-10 US disclosed
WO-2009125870-A1 PYRIMIDINE, PYRIDINE AND TRIAZINE DERIVATIVES AS MAXI-K CHANNEL OPENERS. MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-10-15 WO disclosed
US-20090105271-A1 PYRIDYL SULFONAMIDES AS MODULATORS OF ION CHANNELS VERTEX PHARMACEUTICALS INCORPORATED 2009-04-23 US disclosed
US-20090042862-A1 NOVEL COMPOUNDS BEST DESMOND JOHN 2009-02-12 US disclosed
US-20090042862-A1 NOVEL COMPOUNDS BEST DESMOND JOHN 2009-02-12 US disclosed
US-7446103-B2 Bicyclic benzamide compound as histamine H3 receptor ligand useful in the treatment of neurological diseases GLAXO GROUP LIMITED (GB) 2008-11-04 US disclosed
US-7446103-B2 Bicyclic benzamide compound as histamine H3 receptor ligand useful in the treatment of neurological diseases GLAXO GROUP LIMITED (GB) 2008-11-04 US disclosed
US-20080027067-A1 Heterocyclic derivatives as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED 2008-01-31 US disclosed
US-20070105838-A1 Bicyclic Benzamide Compoundssa as Histamine H3 Receptor Ligand Useful in the Treatment of Neurological Diseases GLAXO GROUP LIMITED (GB) 2007-05-10 US disclosed
US-20070105838-A1 Bicyclic Benzamide Compoundssa as Histamine H3 Receptor Ligand Useful in the Treatment of Neurological Diseases GLAXO GROUP LIMITED (GB) 2007-05-10 US 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-20070105838-A1 Bicyclic Benzamide Compoundssa as Histamine H3 Receptor Ligand Useful in the Treatment of Neurological Diseases HRH3, HRH4, HRH1 MAOA 142/4885MAOB 201/4885SLC6A4 866/4885
US-20090042862-A1 NOVEL COMPOUNDS GRIN2C, GRIN2A, GRIN2B MAOA 44/4885MAOB 29/4885SLC6A4 139/4885
US-20230339902-A1 TRICYCLIC LIGANDS FOR DEGRADATION OF IKZF2 OR IKZF4 IKZF1, IKZF3, IKZF2 MAOA 4265/4885MAOB 4489/4885SLC6A4 4312/4885
US-20080027067-A1 Heterocyclic derivatives as modulators of ion channels TRPV1, KCNJ2, KCNN3 MAOA 885/4885MAOB 1062/4885SLC6A4 351/4885
US-20090105271-A1 PYRIDYL SULFONAMIDES AS MODULATORS OF ION CHANNELS KCNJ2, TRPV1, KCNJ1 MAOA 2275/4885MAOB 2370/4885SLC6A4 271/4885
US-20100144701-A1 Modulators of CB1 Receptors CNR1, CNR2, GPR6 MAOA 2327/4885MAOB 1347/4885SLC6A4 1525/4885
US-20170355679-A1 FLUORINATED 2-AMINO-4-(SUBSTITUTED AMINO)PHENYL CARBAMATE DERIVATIVES KCNQ2, KCNQ1, KCNQ3 MAOA 4109/4885MAOB 3644/4885SLC6A4 268/4885
US-20230346764-A1 Methods and Compositions for Treating Pruritus, Xerosis, and Associated Disease Using CCR3-Inhibitors CCR3, CCR1, CCR4 MAOA 4339/4885MAOB 3867/4885SLC6A4 3574/4885
US-20200031828-A1 AZAPHENALENE-3-ONE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATION THEROF PARP1, PARP11, PARP8 MAOA 1787/4885MAOB 1960/4885SLC6A4 4729/4885
US-10669274-B2 Azaphenalene-3-one derivative, preparation method therefor, and application therof PARP1, PARP11, PARP8 MAOA 1787/4885MAOB 1960/4885SLC6A4 4729/4885

“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.