SCHEMBL675442

SCHEMBL675442

COc1c(NC(=O)c2ccc(-c3ccc(-c4noc(C)n4)cc3C)cc2)cccc1N1CCN(C)CC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 14/20 0.71
HTR1B P28222 9/20 0.71
HTR2A P28223 7/20 0.71
MAPT P10636 4/20 0.71
SLC6A4 P31645 4/20 0.71
MEN1 O00255 3/20 0.71
KMT2A Q03164 3/20 0.71
TDP1 Q9NUW8 3/20 0.71
TP53 P04637 2/20 0.71
CYP3A4 P08684 2/20 0.71
CYP2D6 P10635 2/20 0.71
MAPK1 P28482 2/20 0.71
HSD17B10 Q99714 2/20 0.71
HTR1A P08908 2/20 0.71
HTR2C P28335 2/20 0.71
HTR3E A5X5Y0 1/20 0.71
HTR3B O95264 1/20 0.71
CYP2C9 P11712 1/20 0.71
TSHR P16473 1/20 0.71
NFKB1 P19838 1/20 0.71

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
Gr-127935 SCHEMBL29462286 0.83 HTR1D (1.00) HTR1DHTR1BHTR2AMAPTSLC6A4
Gr-127935 SCHEMBL7795263 0.83 HTR1D (1.00) HTR1DHTR1BHTR2AMAPTSLC6A4
Gr-127935 SCHEMBL29657121 0.82 MEN1 (1.00) HTR1DHTR1BHTR2AMAPTSLC6A4
Gr-127935 SCHEMBL6017123 0.82 MEN1 (1.00) HTR1DHTR1BHTR2AMAPTSLC6A4
SCHEMBL9567470 0.82 HTR1D (0.53) HTR1DHTR1BHTR2AMAPTSLC6A4
SCHEMBL7801411 0.80 HTR1D (1.00) HTR1DHTR1BHTR2AMAPTSLC6A4
SCHEMBL7803385 0.79 HTR1D (0.69) HTR1DHTR1BHTR2AMAPTSLC6A4
SCHEMBL7801017 0.79 HTR1D (0.83) HTR1DHTR1BHTR2AMAPTSLC6A4
SCHEMBL7801056 0.79 HTR1D (0.83) HTR1DHTR1BHTR2AMAPTSLC6A4
SCHEMBL7795147 0.78 HTR1D (0.91) HTR1DHTR1BHTR2AMAPTSLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170246150-A1 Arthroscopic irrigation solution and method for peripheral vasoconstriction and inhibition of pain and inflammation OMEROS CORPORATION 2017-08-31 US disclosed
US-20170182007-A1 Arthroscopic Irrigation Solution and Method for Peripheral Vasoconstriction and Inhibition of Pain and Inflammation OMEROS CORPORATION 2017-06-29 US disclosed
US-20160184272-A1 Arthroscopic irrigation solution and method for peripheral vasoconstriction and inhibition of pain and inflammation OMEROS CORPORATION 2016-06-30 US disclosed
US-20160120846-A1 Arthroscopic Irrigation Solution and Method for Peripheral Vasoconstriction and Inhibition of Pain and Inflammation OMEROS CORPORATION 2016-05-05 US disclosed
US-20160067219-A1 Arthroscopic Irrigation Solution and Method for Peripheral Vasoconstriction and Inhibition of Pain and Inflammation OMEROS CORPORATION 2016-03-10 US disclosed
US-9254271-B2 Arthroscopic irrigation solution and method for peripheral vasoconstriction and inhibition of pain and inflammation OMEROS CORPORATION (US) 2016-02-09 US disclosed
US-20130324475-A1 Arthroscopic Irrigation Solution and Method for Peripheral Vasoconstriction and Inhibition of Pain and Inflammation OMEROS CORPORATION (US) 2013-12-05 US disclosed
US-8450309-B2 Arthroscopic irrigation solution and method for peripheral vasoconstriction and inhibition of pain and inflammation OMEROS CORPORATION (US) 2013-05-28 US disclosed
EP-2301562-B1 Irrigation solution and method for inhibition of pain, inflammation and spasm OMEROS CORP (US) 2013-04-17 EP disclosed
EP-1609477-B1 Irrigation solution and use thereof for the perioperative inhibition of pain/inflammation and/or spasm at a vascular structure OMEROS CORP (US) 2011-11-09 EP disclosed
US-20030087962-A1 Arthroscopic irrigation solution and method for peripheral vasoconstriction and inhibition of pain and inflammation OMEROS CORPORATION 2003-05-08 US disclosed
US-6492332-B1 Irrigation solution and methods for inhibition of tumor cell adhesion, pain and inflammation OMEROS CORPORATION 2002-12-10 US disclosed
US-6420432-B2 DELIVERING ANALGESICS, ANTIINFLAMMATORY AGENTS, AND OTHER ENZYME AND RECEPTOR INHIBITORS LOCALLY TO A WOUND; REDUCED SIDE EFFECTS COMPARED TO SYSTEMIC DELIVERY OMEROS CORPORATION 2002-07-16 US disclosed
US-20020028798-A1 Irrigation solution and method for inhibition of pain and inflammation OMEROS MEDICAL SYSTEMS 2002-03-07 US disclosed
US-20010044616-A1 Surgical irrigation solution and method for inhibition of pain and inflammation OMEROS MEDICAL SYSTEMS, INC. 2001-11-22 US disclosed
US-6261279-B1 Surgical irrigation solution and method for inhibition of pain and inflammation OMEROS MEDICAL SYSTEMS, INC. 2001-07-17 US disclosed
US-6254585-B1 Surgical irrigation solution and method for inhibition of pain and inflammation OMEROS MEDICAL SYSTEMS, INC. 2001-07-03 US disclosed
US-6242447-B1 AVOIDING UNDESIRABLE SIDE EFFECTS ASSOCIATED WITH ORAL, INTRAMUSCULAR, SUBCUTANEOUS OR INTRAVENOUS APPLICATION OF LARGER DOSES OF THE AGENTS. OMEROS MEDICAL SYSTEMS, INC. 2001-06-05 US disclosed
US-6210394-B1 Surgical irrigation solution and method for inhibition of pain and inflammation OMEROS MEDICAL SYSTEMS, INC. 2001-04-03 US disclosed
US-6056715-A Surgical irrigation solution and method for inhibition of pain and inflammation OMEROS MEDICAL SYSTEMS, INC. (US) 2000-05-02 US disclosed