SCHEMBL16081101

SCHEMBL16081101

CC(C)OC(=O)[C@@H](C)N[P@@](=O)(Oc1ccccc1)Oc1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 12/20 0.50
CYP3A4 P08684 2/20 0.44
CYP2C9 P11712 2/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL2521572 1.00 BTN3A1 (0.50) BTN3A1CYP3A4CYP2C9MEN1KMT2A
SCHEMBL16690101 1.00 BTN3A1 (0.50) BTN3A1CYP3A4CYP2C9MEN1KMT2A
SCHEMBL2521573 1.00 BTN3A1 (0.50) BTN3A1CYP3A4CYP2C9MEN1KMT2A
SCHEMBL2549985 1.00 BTN3A1 (0.50) BTN3A1CYP3A4CYP2C9MEN1KMT2A
SCHEMBL30208193 1.00 BTN3A1 (0.50) BTN3A1CYP3A4CYP2C9MEN1KMT2A
SCHEMBL2510991 1.00 BTN3A1 (0.50) BTN3A1CYP3A4CYP2C9MEN1KMT2A
SCHEMBL2512431 1.00 BTN3A1 (0.50) BTN3A1CYP3A4CYP2C9MEN1KMT2A
SCHEMBL850195 1.00 BTN3A1 (0.50) BTN3A1CYP3A4CYP2C9MEN1KMT2A
SCHEMBL2510990 1.00 BTN3A1 (0.50) BTN3A1CYP3A4CYP2C9MEN1KMT2A
SCHEMBL19821287 0.95 BTN3A1 (0.47) BTN3A1CYP3A4CYP2C9MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024147408-A1 (R,RP)-ISOMER OF 2'-FLUORO-6'-METHYLENE CARBOCYCLIC ADENOSINE MONOPHOSPHATE PRODRUG, AND USE THEREOF IMMUNODESIGNERS CO., LTD. (KR) 2024-07-11 WO disclosed
US-10251903-B2 Process for making nucleoside phosphoramidate compounds MERCK SHARP & DOHME CORP. (US) 2019-04-09 US disclosed
US-20180111954-A1 PROCESS FOR MAKING PHOSPHORAMIDATE PROTECTED NUCLEOSIDE COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2018-04-26 US disclosed
US-20170275327-A1 SUBSTITUTED PHOSPHORAMIDATE COMPOUNDS AND USES THEREOF MERCK SHARP & DOHME LLC 2017-09-28 US disclosed
US-20170246198-A1 Process for Making Nucleoside Phosphoramidate Compounds IDENIX PHARMACEUTICALS LLC (US) 2017-08-31 US disclosed
US-20170246198-A1 Process for Making Nucleoside Phosphoramidate Compounds IDENIX PHARMACEUTICALS LLC (US) 2017-08-31 US disclosed
WO-2017019581-A1 PROCESS FOR MAKING PHOSPHORUS-CONTAINING NUCLEOSIDE PRODRUG COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2017-02-02 WO disclosed
WO-2016181313-A1 A PROCESS FOR THE PREPARATION OF SOFOSBUVIR INTERMEDIATES & ITS POLYMORPH LUPIN LIMITED (IN) 2016-11-17 WO disclosed
WO-2016160646-A1 PROCESS FOR MAKING PHOSPHORAMIDATE PROTECTED NUCLEOSIDE COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2016-10-06 WO disclosed
US-20160271162-A1 D-ALANINE PHOSPHORAMIDE PRONUCLEOTIDES OF 2'-METHYL 2'-FLURO GUANOSINE NUCLEOSIDE COMPOUNDS FOR THE TREATMENT OF HCV IDENIX PHARMACUETICALS, LLC (US) 2016-09-22 US disclosed
US-20160271162-A1 D-ALANINE PHOSPHORAMIDE PRONUCLEOTIDES OF 2'-METHYL 2'-FLURO GUANOSINE NUCLEOSIDE COMPOUNDS FOR THE TREATMENT OF HCV IDENIX PHARMACUETICALS, LLC (US) 2016-09-22 US disclosed
US-20160113956-A1 AMINO ACID PHOSPHORAMIDATE PRONUCLEOTIDES OF 2'-CYANO, AZIDO AND AMINO NUCLEOSIDES FOR THE TREATMENT OF HCV UNIVERSITE DE MONTPELLIER (FR) 2016-04-28 US disclosed
US-20160113956-A1 AMINO ACID PHOSPHORAMIDATE PRONUCLEOTIDES OF 2'-CYANO, AZIDO AND AMINO NUCLEOSIDES FOR THE TREATMENT OF HCV UNIVERSITE DE MONTPELLIER (FR) 2016-04-28 US disclosed
US-20160002281-A1 D-AMINO ACID COMPOUNDS FOR LIVER DISEASE UNIVERSITE DE MONTPELLIER (FR) 2016-01-07 US disclosed
US-20140271547-A1 AMINO ACID PHOSPHORAMIDATE PRONUCLEOTIDES OF 2'-CYANO, AZIDO AND AMINO NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. 2014-09-18 US disclosed
US-20140271547-A1 AMINO ACID PHOSPHORAMIDATE PRONUCLEOTIDES OF 2'-CYANO, AZIDO AND AMINO NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. 2014-09-18 US 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 (8 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-20170246198-A1 Process for Making Nucleoside Phosphoramidate Compounds PNP, NUDT1, NUDT14 BTN3A1 4161/4885CYP3A4 418/4885CYP2C9 308/4885
US-20170275327-A1 SUBSTITUTED PHOSPHORAMIDATE COMPOUNDS AND USES THEREOF ADH1A, ADH1C, ADH5 BTN3A1 2751/4885CYP3A4 352/4885CYP2C9 843/4885
US-20180111954-A1 PROCESS FOR MAKING PHOSPHORAMIDATE PROTECTED NUCLEOSIDE COMPOUNDS PNP, NUDT1, RNGTT BTN3A1 2834/4885CYP3A4 1804/4885CYP2C9 402/4885
US-10251903-B2 Process for making nucleoside phosphoramidate compounds PNP, NUDT1, NUDT14 BTN3A1 4161/4885CYP3A4 418/4885CYP2C9 308/4885
US-20160113956-A1 AMINO ACID PHOSPHORAMIDATE PRONUCLEOTIDES OF 2'-CYANO, AZIDO AND AMINO NUCLEOSIDES FOR THE TREATMENT OF HCV PNP, RNGTT, NSUN2 BTN3A1 2902/4885CYP3A4 4062/4885CYP2C9 3258/4885
US-20140271547-A1 AMINO ACID PHOSPHORAMIDATE PRONUCLEOTIDES OF 2'-CYANO, AZIDO AND AMINO NUCLEOSIDES FOR THE TREATMENT OF HCV PNP, RNGTT, NSUN2 BTN3A1 2902/4885CYP3A4 4062/4885CYP2C9 3258/4885
US-20160002281-A1 D-AMINO ACID COMPOUNDS FOR LIVER DISEASE AADAT, BCAT1, BCAT2 BTN3A1 2388/4885CYP3A4 3762/4885CYP2C9 3241/4885
US-20160271162-A1 D-ALANINE PHOSPHORAMIDE PRONUCLEOTIDES OF 2'-METHYL 2'-FLURO GUANOSINE NUCLEOSIDE COMPOUNDS FOR THE TREATMENT OF HCV PNP, RNMT, ADAR BTN3A1 4143/4885CYP3A4 3672/4885CYP2C9 3002/4885

“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.