SCHEMBL3755012

SCHEMBL3755012

CC(NP(=O)(OC[C@@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](C)(F)C1O)Oc1ccccc1)C(=O)O

nearest known ligand 0.86

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.86
CYP2C9 P11712 2/20 0.86
P2RY2 P41231 9/20 0.47
P2RY6 Q15077 6/20 0.47
P2RY14 Q15391 2/20 0.47
P2RY4 P51582 3/20 0.47
POLA1 P09884 1/20 0.46

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
SCHEMBL17451182 1.00 CYP3A4 (0.86) CYP3A4CYP2C9P2RY2P2RY6P2RY14
SCHEMBL19283470 1.00 CYP3A4 (0.86) CYP3A4CYP2C9P2RY2P2RY6P2RY14
SCHEMBL15876420 1.00 CYP3A4 (0.86) CYP3A4CYP2C9P2RY2P2RY6P2RY14
SCHEMBL15876419 1.00 CYP3A4 (0.86) CYP3A4CYP2C9P2RY2P2RY6P2RY14
SCHEMBL2525660 1.00 CYP3A4 (0.86) CYP3A4CYP2C9P2RY2P2RY6P2RY14
SCHEMBL3755009 1.00 CYP3A4 (0.86) CYP3A4CYP2C9P2RY2P2RY6P2RY14
SCHEMBL2525662 1.00 CYP3A4 (0.86) CYP3A4CYP2C9P2RY2P2RY6P2RY14
SCHEMBL15728982 1.00 CYP3A4 (0.86) CYP3A4CYP2C9P2RY2P2RY6P2RY14
SCHEMBL2525665 1.00 CYP3A4 (0.86) CYP3A4CYP2C9P2RY2P2RY6P2RY14
SCHEMBL28720279 0.95 CYP3A4 (0.79) CYP3A4CYP2C9P2RY2P2RY6P2RY14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3321275-B1 CRYSTALLINE FORM OF SOFOSBUVIR GILEAD SCIENCES INC (US) 2022-07-13 EP disclosed
EP-3290428-B1 TABLET COMPRISING CRYSTALLINE (S)-ISOPROPYL 2-(((S)-(((2R,3R,4R,5R)-5-(2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1 (2H)-YL)-4-FLUORO-3-HYDROXY-4-METHYLTETRAHYDROFURAN-2-YL)METHOXY)(PHENOXY)PHOSPHORYL)AMINO)PROPANOATE GILEAD PHARMASSET LLC (US) 2021-10-13 EP disclosed
CN-105085592-B N- [ (2' R) -2' -deoxy-2 ' -fluoro-2 ' -methyl-P-phenyl-5 ' -uridylyl ] -L-alanine 1-methylethyl ester and process for preparing same 吉利德制药有限责任公司 2021-04-27 CN disclosed
EP-3321275-A1 CRYSTALLINE FORM OF SOFOSBUVIR Gilead Pharmasset LLC (US) 2018-05-16 EP disclosed
EP-3290428-A1 TABLET COMPRISING CRYSTALLINE (S)-ISOPROPYL 2-(((S)-(((2R,3R,4R,5R)-5-(2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1 (2H)-YL)-4-FLUORO-3-HYDROXY-4-METHYLTETRAHYDROFURAN-2-YL)METHOXY)(PHENOXY)PHOSPHORYL)AMINO)PROPANOATE Gilead Pharmasset LLC (US) 2018-03-07 EP disclosed
US-20180044367-A1 NUCLEOSIDE PHOSPHORAMIDATES PHARMASSET, INC. 2018-02-15 US disclosed
EP-2913337-B1 PROCESS FOR THE PRODUCTION OF SOFOSBUVIR GILEAD PHARMASSET LLC (US) 2017-09-06 EP disclosed
EP-2609923-B1 PROCESS FOR THE CRYSTALLISATION OF (S)-ISOPROPYL 2-(((S)-(PERFLUOROPHENOXY)(PHENOXY)PHOSPHORYL)AMINO)PROPANOATE GILEAD PHARMASSET LLC (US) 2017-05-24 EP disclosed
US-9637512-B2 Nucleoside phosphoramidates GILEAD PHARMASSET LLC (US) 2017-05-02 US disclosed
US-20160354400-A1 NUCLEOSIDE PHOSPHORAMIDATES PHARMASSET, INC. 2016-12-08 US disclosed
US-8618076-B2 Nucleoside phosphoramidates GILEAD PHARMASSET LLC (US) 2013-12-31 US disclosed
US-20130310551-A1 NUCLEOSIDE PHOSPHORAMIDATES GILEAD SCIENCES, INC. 2013-11-21 US disclosed
US-20130288997-A1 NUCLEOSIDE PHOSPHORAMIDATES GILEAD SCIENCES, INC. 2013-10-31 US disclosed
EP-2610264-A2 N-[(2'r)-2'-deoxy-2'-fluoro-2'-methyl-p-phenyl-5'-uridylyl]-l-alanine 1-methylethyl ester and process for its production Gilead Pharmasset LLC (US) 2013-07-03 EP disclosed
EP-2609923-A2 Nucleoside Phosphoramidates Gilead Pharmasset LLC (US) 2013-07-03 EP disclosed
US-20130165401-A1 NUCLEOSIDE PHOSPHORAMIDATES GILEAD PHARMASSET LLC (US) 2013-06-27 US disclosed
US-20130165644-A1 NUCLEOSIDE PHOSPHORAMIDATES GILEAD PHARMASSET LLC (US) 2013-06-27 US disclosed
US-20130137654-A1 NUCLEOSIDE PHOSPHORAMIDATES GILEAD PHARMASSET LLC (US) 2013-05-30 US disclosed
US-20130078613-A1 Selection of HCV Treatment ROCHE MOLECULAR SYSTEMS (US) 2013-03-28 US disclosed
US-20100298257-A1 NUCLEOSIDE PHOSPHORAMIDATES PHARMASSET, INC. (US) 2010-11-25 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-20130165644-A1 NUCLEOSIDE PHOSPHORAMIDATES PNP, RNGTT, NSUN2 CYP3A4 3811/4885CYP2C9 3971/4885P2RY2 1380/4885
US-20130310551-A1 NUCLEOSIDE PHOSPHORAMIDATES PNP, RNGTT, NSUN2 CYP3A4 3916/4885CYP2C9 4098/4885P2RY2 1271/4885
US-20130137654-A1 NUCLEOSIDE PHOSPHORAMIDATES PNP, RNGTT, NSUN2 CYP3A4 3811/4885CYP2C9 3971/4885P2RY2 1380/4885
US-20100298257-A1 NUCLEOSIDE PHOSPHORAMIDATES PNP, RNGTT, NSUN2 CYP3A4 3811/4885CYP2C9 3971/4885P2RY2 1380/4885
US-20130165401-A1 NUCLEOSIDE PHOSPHORAMIDATES PNP, RNGTT, NSUN2 CYP3A4 3811/4885CYP2C9 3971/4885P2RY2 1380/4885
US-20130288997-A1 NUCLEOSIDE PHOSPHORAMIDATES PNP, RNGTT, NSUN2 CYP3A4 3916/4885CYP2C9 4098/4885P2RY2 1271/4885
US-20160354400-A1 NUCLEOSIDE PHOSPHORAMIDATES PNP, RNGTT, NSUN2 CYP3A4 3916/4885CYP2C9 4098/4885P2RY2 1271/4885
US-20180044367-A1 NUCLEOSIDE PHOSPHORAMIDATES PNP, RNGTT, NSUN2 CYP3A4 3811/4885CYP2C9 3971/4885P2RY2 1380/4885

“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.