SCHEMBL8290709

SCHEMBL8290709

CN(C)Cc1ccc(F)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.47
HRH3 Q9Y5N1 1/20 0.45
SLC6A4 P31645 4/20 0.45
SLC6A2 P23975 3/20 0.45
SLC6A3 Q01959 3/20 0.45
HTR1A P08908 1/20 0.44
HTR1D P28221 1/20 0.44
HTR1B P28222 1/20 0.44
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
HTR1E P28566 1/20 0.44
HTR7 P34969 1/20 0.44
HTR2B P41595 1/20 0.44
HTR3A P46098 1/20 0.44
HTR5A P47898 1/20 0.44
HTR6 P50406 1/20 0.44
EGFR P00533 1/20 0.43
POLB P06746 1/20 0.42
PYCR1 P32322 1/20 0.42
SOS1 Q07889 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
SCHEMBL23992712 0.84 HTR1A (0.47) TAAR1HRH3SLC6A4SLC6A2SLC6A3
SCHEMBL22651830 0.82 CNR2 (0.40) SLC6A4SLC6A2SLC6A3HTR2APYCR1
SCHEMBL4804093 0.81 SLC6A2 (0.62) TAAR1HRH3SLC6A4SLC6A2SLC6A3
SCHEMBL23972532 0.81 HRH3 (0.50) TAAR1HRH3SLC6A4SLC6A2SLC6A3
SCHEMBL18137974 0.80 SIGMAR1 (0.46) PYCR1PIK3CAALDH1A1TSHRMEN1
Hydrochloric Acid SCHEMBL2166733 0.79 SLC6A2 (0.61) TAAR1HRH3SLC6A4SLC6A2SLC6A3
SCHEMBL16646881 0.78 HRH3 (0.46) TAAR1HRH3SLC6A4SLC6A2SLC6A3
SCHEMBL257081 0.77 TSHR (0.44) TAAR1SOS1PIK3CAALDH1A1TSHR
SCHEMBL29354626 0.77 PIK3CA (0.44) TAAR1SLC6A4SLC6A3SOS1PIK3CA
SCHEMBL118390 0.77 PIK3CA (0.44) TAAR1SLC6A4SLC6A3SOS1PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022192730-A1 COMPOSITIONS AND METHODS FOR TREATING POLYCYTHEMIA DISC MEDICINE, INC. (US) 2022-09-15 WO disclosed
US-7812031-B2 such as 2-Dimethylamino-4-phenylpyrimidine-5-carboxylic acid [2-hydroxy-2-(3-hydroxyphenyl)ethyl]methyl amide, used for the treatment of obesity, including obesity of the non-insulin-dependent diabetes patients, sleeping disorders, stroke, nausea and vomiting SANOFI-AVENTIS (FR) 2010-10-12 US disclosed
US-7812031-B2 such as 2-Dimethylamino-4-phenylpyrimidine-5-carboxylic acid [2-hydroxy-2-(3-hydroxyphenyl)ethyl]methyl amide, used for the treatment of obesity, including obesity of the non-insulin-dependent diabetes patients, sleeping disorders, stroke, nausea and vomiting SANOFI-AVENTIS (FR) 2010-10-12 US disclosed
US-7538112-B2 HIV integrase inhibitors MERCK & CO., INC. (US) 2009-05-26 US disclosed
US-20080287394-A1 Hiv Integrase Inhibitors MERCK & CO., INC. (US) 2008-11-20 US disclosed
US-20070043037-A1 PYRIMIDINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS SANOFI-AVENTIS (FR) 2007-02-22 US disclosed
US-20070043037-A1 PYRIMIDINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS SANOFI-AVENTIS (FR) 2007-02-22 US disclosed
WO-2005075458-A1 PYRIMIDINE DERIVATIVES AS OREXIN RECEPTORS ANTAGONISTS SANOFI-AVENTIS (FR) 2005-08-18 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-20070043037-A1 PYRIMIDINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS HCRTR2, HCRTR1, NPY1R TAAR1 59/4885HRH3 22/4885SLC6A4 462/4885
US-20080287394-A1 Hiv Integrase Inhibitors DHPS, DPYD, TYMP TAAR1 4628/4885HRH3 548/4885SLC6A4 4233/4885

“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.