SCHEMBL434111

SCHEMBL434111

Cc1ccc(OC(=O)CN(C)C)c(CCCc2cccc(N(C(C)C)C(C)C)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 3/20 0.42
PTGER4 P35408 2/20 0.42
PTGER3 P43115 2/20 0.42
PTGER2 P43116 2/20 0.42
KMT2A Q03164 4/20 0.34
MEN1 O00255 2/20 0.34
TSHR P16473 2/20 0.34
FFAR4 Q5NUL3 2/20 0.34
FDPS P14324 1/20 0.34
FFAR1 O14842 1/20 0.34
ACHE P22303 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
ATM Q13315 1/20 0.33
PDGFRB P09619 1/20 0.33
PDGFRA P16234 1/20 0.33
PRKCE Q02156 1/20 0.33
LTB4R Q15722 2/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL725536 0.90 PTGER1 (0.43) PTGER1PTGER4PTGER3PTGER2KMT2A
SCHEMBL4660356 0.81 ESR1 (0.35) PTGER1PTGER4PTGER3PTGER2KMT2A
SCHEMBL3721174 0.79 IGF1R (0.39) PTGER1PTGER4PTGER3PTGER2KMT2A
SCHEMBL1158253 0.79 CHRM2 (0.45) LTB4R
SCHEMBL4661559 0.78 ALOX15 (0.41)
SCHEMBL7755007 0.78 ADRB2 (0.41) PTGER1PTGER4PTGER3PTGER2FFAR4
Hydrochloric Acid SCHEMBL16166428 0.78 CHRM2 (0.45) LTB4R
SCHEMBL724700 0.78 ADRB2 (0.39) PTGER1PTGER4PTGER3PTGER2ALDH1A1
SCHEMBL7755603 0.77 ALOX15 (0.40) PTGER1PTGER4PTGER3PTGER2
SCHEMBL4659041 0.76 CHRM2 (0.39) PTGER1PTGER4PTGER3PTGER2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4346772-A1 PHOSPHOLIPID FORMULATIONS OF 1'-CYANO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS GILEAD SCIENCES, INC. (US) 2024-04-10 EP disclosed
WO-2024006461-A1 SOLID FORMS OF A NUCLEOSIDE ANALOGUE AND USES THEREOF GILEAD SCIENCES, INC. (US) 2024-01-04 WO disclosed
EP-4132651-A1 INHALATION FORMULATIONS OF 1'-CYANO SUBSTITUTED CARBANUCLEOSIDE ANALOGS GILEAD SCIENCES, INC. (US) 2023-02-15 EP disclosed
EP-4106766-A1 A 5-(4-AMINOPYRROLO[2,1-F][1,2,4]TRIAZIN-7-YL)-2-CYANO-3,4-DIHYDROXYTETRAHYDROFURANE DERIVATIVE AS ANTIVIRAL AGENT Gilead Sciences, Inc. (US) 2022-12-28 EP disclosed
EP-2838900-A1 COMPOUNDS AND METHODS FOR ANTIVIRAL TREATMENT Gilead Sciences, Inc. (US) 2015-02-25 EP disclosed
EP-2834258-A1 2'- SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT Gilead Sciences, Inc. (US) 2015-02-11 EP disclosed
EP-2794611-A1 PYRAZOLO[1,5-A]PYRIMIDINES AS ANTIVIRAL AGENTS Gilead Sciences, Inc. (US) 2014-10-29 EP disclosed
WO-2013158776-A1 COMPOUNDS AND METHODS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2013-10-24 WO disclosed
WO-2013138236-A1 2'- SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES , INC. (US) 2013-09-19 WO disclosed
EP-2616080-A1 2' -FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT Gilead Sciences, Inc. (US) 2013-07-24 EP disclosed
WO-2013096681-A1 PYRAZOLO[1,5-A]PYRIMIDINES AS ANTIVIRAL AGENTS GILEAD SCIENCES, INC. (US) 2013-06-27 WO disclosed
EP-2595980-A1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS Gilead Sciences, Inc. (US) 2013-05-29 EP disclosed
EP-2585467-A1 PYRAZOLO [1, 5 -A]PYRIMIDINES AS ANTIVIRAL AGENTS Gilead Sciences, Inc. (US) 2013-05-01 EP disclosed
WO-2012037038-A1 2' -FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2012-03-22 WO disclosed
WO-2012012776-A1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES, INC. (US) 2012-01-26 WO disclosed
WO-2011163518-A1 PYRAZOLO [1, 5 -A] PYRIMIDINES AS ANTIVIRAL AGENTS GILEAD SCIENCES, INC. (US) 2011-12-29 WO disclosed
EP-2114972-A2 MONOPHOSPHATES AS MUTUAL PRODRUGS OF MUSCARINIC RECEPTOR ANTAGONISTS AND BETA-AGONISTS FOR THE TREATMENT OF COPD AND CHRONIC BRONCHITIS Gilead Sciences, Inc. (US) 2009-11-11 EP disclosed
WO-2008076269-A2 MONOPHOSPHATES AS MUTUAL PRODRUGS OF MUSCARINIC RECEPTOR ANTAGONISTS AND β-AGONISTS FOR THE TREATMENT OF COPD AND CHRONIC BRONCHITIS GILEAD SCIENCES, INC. (US) 2008-06-26 WO disclosed