SCHEMBL2248107

SCHEMBL2248107

CN(C)C1Cc2ccccc2C1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.54
HTR2A P28223 12/20 0.53
HTR2C P28335 12/20 0.53
HTR2B P41595 12/20 0.53
HRH3 Q9Y5N1 12/20 0.53
SIGMAR1 Q99720 3/20 0.53
HTR1A P08908 2/20 0.49
HTR7 P34969 2/20 0.49

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
SCHEMBL31808827 1.00 DRD3 (0.54) DRD3HTR2AHTR2CHTR2BHRH3
Hydrochloric Acid SCHEMBL10462146 0.91 SIGMAR1 (0.50) DRD3HTR2AHTR2CHTR2BHRH3
SCHEMBL823058 0.84 HTR1A (0.61) DRD3HTR1AHTR7
SCHEMBL29507805 0.84 HTR1A (0.61) DRD3HTR1AHTR7
SCHEMBL1950024 0.84 HTR1A (0.61) DRD3HTR1AHTR7
SCHEMBL822940 0.84 HTR1A (0.61) DRD3HTR1AHTR7
SCHEMBL7092682 0.84 DRD3 (0.54) DRD3HTR2AHTR2CHTR2BHRH3
Hydrochloric Acid SCHEMBL29064497 0.83 HTR1A (0.59) DRD3HTR1AHTR7
SCHEMBL10463903 0.83 MAOA (0.50) HTR2AHTR2CHTR2BHRH3SIGMAR1
SCHEMBL10462534 0.83 BRD4 (0.49) HTR2AHTR2CHTR2BHRH3SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1924553-A1 BICYCLO[2.2.]HEPT-7-YLAMINE DERIVATIVES AND THEIR USES Argenta Discovery Limited (GB) 2008-05-28 EP claimed
WO-2007017670-A1 BICYCLO[2.2.]HEPT-7-YLAMINE DERIVATIVES AND THEIR USES ARGENTA DISCOVERY LTD. (GB) 2007-02-15 WO claimed
CN-118221656-A Compounds useful for the treatment of gastrointestinal disorders 阿德利克斯股份有限公司 2024-06-21 CN disclosed
CN-114315796-B Compounds used as HPK1 kinase inhibitor, preparation method and application thereof 中国药科大学 2024-03-26 CN disclosed
CN-110267944-B Compounds useful for the treatment of gastrointestinal disorders 阿德利克斯股份有限公司 2024-03-08 CN disclosed
CN-114315796-A Compound used as HPK1 kinase inhibitor and preparation method and application thereof 中国药科大学 2022-04-12 CN disclosed
EP-2887964-B1 COMPOUNDS AND METHODS FOR INHIBITING NHE-MEDIATED ANTIPORT IN THE TREATMENT OF DISORDERS ASSOCIATED WITH FLUID RETENTION OR SALT OVERLOAD AND GASTROINTESTINAL TRACT DISORDERS ARDELYX INC (US) 2019-07-03 EP disclosed
US-7989451-B2 Tricyclic 1,2,4-triazine oxides and compositions for therapeutic use in cancer treatments AUCKLAND UNISERVICES LIMITED (NZ) 2011-08-02 US disclosed
US-7989451-B2 Tricyclic 1,2,4-triazine oxides and compositions for therapeutic use in cancer treatments AUCKLAND UNISERVICES LIMITED (NZ) 2011-08-02 US disclosed
US-7989451-B2 Tricyclic 1,2,4-triazine oxides and compositions for therapeutic use in cancer treatments AUCKLAND UNISERVICES LIMITED (NZ) 2011-08-02 US disclosed
CN-102056894-A Homocysteine synthase inhibitor MITSUBISHI TANABE PHARMA CORP 2011-05-11 CN disclosed
EP-1866292-B1 TRICYCLIC 1,2,4-TRIAZINE OXIDES AND COMPOSITIONS THEREFROM FOR THERAPEUTIC USE IN CANCER TREATMENTS AUCKLAND UNISERVICES LTD (NZ) 2010-12-15 EP disclosed
EP-2261218-A2 Process for preparing phenyl-, pyridinyl- or pyrimidinyl-substituted imidazoles Eisai R&D Management Co., Ltd. (JP) 2010-12-15 EP disclosed
US-20090186886-A1 Tricyclic 1,2,4-Triazine Oxides and Compositions for Therapeutic Use in Cancer Treatments AUCKLAND UNISERVICES LIMITED (NZ) 2009-07-23 US disclosed
US-20090186886-A1 Tricyclic 1,2,4-Triazine Oxides and Compositions for Therapeutic Use in Cancer Treatments AUCKLAND UNISERVICES LIMITED (NZ) 2009-07-23 US disclosed
US-20090186886-A1 Tricyclic 1,2,4-Triazine Oxides and Compositions for Therapeutic Use in Cancer Treatments AUCKLAND UNISERVICES LIMITED (NZ) 2009-07-23 US disclosed
EP-1757591-A1 CINNAMIDE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2007-02-28 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 (1 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-20090186886-A1 Tricyclic 1,2,4-Triazine Oxides and Compositions for Therapeutic Use in Cancer Treatments HIF1AN, HIF1A, HYOU1 DRD3 3070/4885HTR2A 269/4885HTR2C 159/4885

“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.