SCHEMBL2659237

SCHEMBL2659237

CC(C)Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.77
HTR2B P41595 3/20 0.77
HTR2C P28335 2/20 0.77
SLC6A4 P31645 3/20 0.66
SIGMAR1 Q99720 2/20 0.66
ADRA2C P18825 2/20 0.66
ADRA1A P35348 2/20 0.66
DRD3 P35462 2/20 0.66
LMNA P02545 1/20 0.66
MAPT P10636 1/20 0.66
OPRK1 P41145 1/20 0.66
CYP3A4 P08684 3/20 0.56
CYP1A2 P05177 2/20 0.56
CYP2D6 P10635 2/20 0.56
TP53 P04637 1/20 0.56
TSHR P16473 1/20 0.56
CYP2C19 P33261 1/20 0.56
TAAR1 Q96RJ0 1/20 0.55
IDO1 P14902 2/20 0.53
EPHX1 P07099 3/20 0.51

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
SCHEMBL21115995 0.90 HTR2A (0.63) HTR2AHTR2BHTR2CSLC6A4SIGMAR1
Nordexfenfluramine SCHEMBL30081489 0.87 HTR2A (1.00) HTR2AHTR2BHTR2CSLC6A4SIGMAR1
Nordexfenfluramine SCHEMBL895637 0.87 HTR2A (1.00) HTR2AHTR2BHTR2CSLC6A4SIGMAR1
Nordexfenfluramine SCHEMBL29390405 0.87 HTR2A (1.00) HTR2AHTR2BHTR2CSLC6A4SIGMAR1
Nordexfenfluramine SCHEMBL30081494 0.87 HTR2A (1.00) HTR2AHTR2BHTR2CSLC6A4SIGMAR1
Nordexfenfluramine SCHEMBL4668266 0.87 HTR2A (1.00) HTR2AHTR2BHTR2CSLC6A4SIGMAR1
Nordexfenfluramine SCHEMBL44927 0.87 HTR2A (1.00) HTR2AHTR2BHTR2CSLC6A4SIGMAR1
SCHEMBL18888417 0.87 HTR2A (0.74) HTR2AHTR2BHTR2CSLC6A4SIGMAR1
SCHEMBL13719227 0.85 HTR2A (0.58) HTR2AHTR2BHTR2CSLC6A4SIGMAR1
SCHEMBL5706525 0.85 HTR2A (0.72) HTR2AHTR2BHTR2CSLC6A4SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240018090-A1 Processes for the Preparation of Fenfluramine THE BANK OF NOVA SCOTIA 2024-01-18 US disclosed
US-20230365568-A1 PLK1 POLO BOX DOMAIN INHIBITORS AND METHOD OF TREATING CANCER THE UNITED STATES OF AMERICA,AS REPRESENTED BY THE SECRETARY,DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-11-16 US disclosed
US-20230365568-A1 PLK1 POLO BOX DOMAIN INHIBITORS AND METHOD OF TREATING CANCER THE UNITED STATES OF AMERICA,AS REPRESENTED BY THE SECRETARY,DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-11-16 US disclosed
US-20230357139-A1 SMALL MOLECULE INHIBITORS OF BACTERIAL TOXINS Artizan Biosciences, Inc. 2023-11-09 US disclosed
US-20230357139-A1 SMALL MOLECULE INHIBITORS OF BACTERIAL TOXINS Artizan Biosciences, Inc. 2023-11-09 US disclosed
US-20230339947-A1 USE OF CASEINOLYTIC PROTEASE P FUNCTION AS A BIOMARKER OF DRUG RESPONSE TO IMIPRIDONE-LIKE AGENTS Madera Therapeutics, LLC 2023-10-26 US disclosed
US-20230339947-A1 USE OF CASEINOLYTIC PROTEASE P FUNCTION AS A BIOMARKER OF DRUG RESPONSE TO IMIPRIDONE-LIKE AGENTS Madera Therapeutics, LLC 2023-10-26 US disclosed
EP-3784669-B1 PTERIDINONE COMPOUNDS AND USES THEREOF VERTEX PHARMA (US) 2023-10-25 EP disclosed
US-11787780-B2 Quaternary indazole glucocorticoid receptor antagonists CORCEPT THERAPEUTICS INCORPORATED (US) 2023-10-17 US disclosed
US-11787780-B2 Quaternary indazole glucocorticoid receptor antagonists CORCEPT THERAPEUTICS INCORPORATED (US) 2023-10-17 US disclosed
US-20070105890-A1 Novel condensed imidazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD 2007-05-10 US disclosed
US-20070105890-A1 Novel condensed imidazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD 2007-05-10 US disclosed
US-20070088071-A1 Acyl indoles, compositions containing such compounds and methods of use MERCK SHARP & DOHME LLC 2007-04-19 US disclosed
US-20070082908-A1 Bicycle pyrazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-12 US disclosed
US-20070082908-A1 Bicycle pyrazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-12 US disclosed
WO-2007022638-A1 BENZODIAZEPINE AND BENZOPIPERAZINE ANALOG INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2007-03-01 WO disclosed
US-20070015797-A1 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method CHENG PETER T 2007-01-18 US disclosed
WO-2006128184-A2 PYRIMIDINE OR TRIAZINE FUSED BICYCLIC METALLOPROTEASE INHIBITORS ALANTOS-PHARMACEUTICALS, INC. (US) 2006-11-30 WO disclosed
US-20040097557-A1 Cyanothiophene derivatives, compositions containing such compounds and methods of use DUFFY JOSEPH L (US) 2004-05-20 US disclosed
EP-0365678-A1 2,5,6,7-TETRANOR-4,8-INTER-m-PHENYLENE PGI 2 DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND USE THEREOF TORAY INDUSTRIES, INC. (JP) 1990-05-02 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 (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-11787780-B2 Quaternary indazole glucocorticoid receptor antagonists NR3C1, NR3C2, MC2R HTR2A 673/4885HTR2B 745/4885HTR2C 433/4885
US-20070105890-A1 Novel condensed imidazole derivative DPP4, DPP7, DPP3 HTR2A 1167/4885HTR2B 602/4885HTR2C 935/4885
US-20230357139-A1 SMALL MOLECULE INHIBITORS OF BACTERIAL TOXINS FABP2, APC, SI HTR2A 3304/4885HTR2B 2817/4885HTR2C 3506/4885
US-20230339947-A1 USE OF CASEINOLYTIC PROTEASE P FUNCTION AS A BIOMARKER OF DRUG RESPONSE TO IMIPRIDONE-LIKE AGENTS CLPP, PRCP, PREP HTR2A 3850/4885HTR2B 3492/4885HTR2C 4218/4885
US-20070088071-A1 Acyl indoles, compositions containing such compounds and methods of use GPR119, IAPP, GLP1R HTR2A 35/4885HTR2B 150/4885HTR2C 56/4885
US-20240018090-A1 Processes for the Preparation of Fenfluramine PNMT, TPH2, CYP4F3 HTR2A 34/4885HTR2B 39/4885HTR2C 12/4885
US-20070082908-A1 Bicycle pyrazole derivative DPP4, DPP7, DPP3 HTR2A 1714/4885HTR2B 764/4885HTR2C 634/4885
US-20070015797-A1 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method GPR119, LIPC, ACACA HTR2A 1983/4885HTR2B 1689/4885HTR2C 3013/4885
US-20230365568-A1 PLK1 POLO BOX DOMAIN INHIBITORS AND METHOD OF TREATING CANCER PLK1, PLK4, BUB1B HTR2A 4853/4885HTR2B 4643/4885HTR2C 4690/4885
US-20040097557-A1 Cyanothiophene derivatives, compositions containing such compounds and methods of use GLP1R, GPR119, GCGR HTR2A 1212/4885HTR2B 854/4885HTR2C 811/4885

“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.