SCHEMBL4130043

SCHEMBL4130043

O=C(OC[C@H]1C[C@H](O)[C@@H](n2cc(F)c(=O)[nH]c2=O)O1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYMS P04818 1/20 0.46
▸ LMNA P02545 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ RNASE1 P07998 1/20 0.44
▸ TSHR P16473 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ PMP22 Q01453 1/20 0.43
▸ HBB P68871 1/20 0.43
▸ P2RY6 Q15077 2/20 0.41
▸ P2RY14 Q15391 2/20 0.41
▸ NT5E P21589 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.40
▸ PPM1B O75688 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

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
SCHEMBL13871560 1.00 TYMS (0.46) TYMSLMNASMN1; SMN2RNASE1TSHR
SCHEMBL5717548 1.00 TYMS (0.46) TYMSLMNASMN1; SMN2RNASE1TSHR
SCHEMBL13871557 0.90 RNASE1 (0.44) TYMSLMNASMN1; SMN2RNASE1TSHR
SCHEMBL5717621 0.86 RNASE1 (0.47) TYMSLMNASMN1; SMN2RNASE1TSHR
SCHEMBL5717714 0.86 RNASE1 (0.47) TYMSLMNASMN1; SMN2RNASE1TSHR
SCHEMBL6285023 0.82 DCK (0.44) NT5EALDH1A1HTTNPC1PPM1B
SCHEMBL13871554 0.81 NPC1 (0.39) RNASE1NT5EALDH1A1HTTNPC1
SCHEMBL24737129 0.80 RNASE1 (0.55) LMNARNASE1ALDH1A1HTTNPC1
SCHEMBL24737131 0.80 RNASE1 (0.55) LMNARNASE1ALDH1A1HTTNPC1
SCHEMBL8888637 0.79 UPP1 (0.43) TYMSLMNASMN1; SMN2RNASE1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105185-A1 Nucleosides with anti-hepatitis B Virus activity SCHINAZI RAYMOND F 2009-04-23 — — US disclosed
US-7468357-B2 Nucleosides with anti-hepatitis B virus activity EMORY UNIVERSITY (US) 2008-12-23 — — US disclosed
EP-1655033-A1 Nucleosides with anti-hepatitis B virus activity Emory University (US) 2006-05-10 — — EP disclosed
EP-1124565-B1 AZIDO DERIVATIVES OF BETA-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HIV INFECTION CENTRE NAT RECH SCIENT (FR) 2006-03-29 — — EP disclosed
EP-1124839-B1 NUCLEOSIDES WITH ANTI-HEPATITIS B VIRUS ACTIVITY CENTRE NAT RECH SCIENT (FR) 2006-01-11 — — EP disclosed
US-20050277616-A1 Thymine nucleosides with anti-hepatitis B virus activity Owens, Howard 2005-12-15 — — US disclosed
US-20020107221-A1 Nucleosides with anti-hepatitis B virus activity SCHINAZI RAYMOND F (US) 2002-08-08 — — US disclosed
US-6407077-B1 ADMINISTERING B-L-(-2*-AZIDO)-2*,3*-DIDEOXY-5-FLUOROCYTIDINE DERIVATIVE; ACQUIRED IMMUNE DEFICIENCY SYNDROMOE (AIDS) TREATMENT EMORY UNIVERSITY 2002-06-18 — — US disclosed
EP-1124839-A2 NUCLEOSIDES WITH ANTI-HEPATITIS B VIRUS ACTIVITY CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2001-08-22 — — EP disclosed
EP-1124565-A1 AZIDO DERIVATIVES OF BETA-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HIV INFECTION CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2001-08-22 — — EP disclosed
WO-2000026225-A2 NUCLEOSIDES WITH ANTI-HEPATITIS B VIRUS ACTIVITY CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2000-05-11 — — WO disclosed
WO-2000025799-A1 β-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HIV INFECTION CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2000-05-11 — — WO disclosed
EP-0831852-A1 NUCLEOSIDES WITH ANTI-HEPATITIS B VIRUS ACTIVITY EMORY UNIVERSITY (US) 1998-04-01 — — 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 (3 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-20020107221-A1 Nucleosides with anti-hepatitis B virus activity PNP, ADA, TYMP TYMS 35/4885LMNA 760/4885SMN1; SMN2 2815/4885
US-20090105185-A1 Nucleosides with anti-hepatitis B Virus activity PNP, TYMP, SAMHD1 TYMS 29/4885LMNA 1088/4885SMN1; SMN2 2377/4885
US-20050277616-A1 Thymine nucleosides with anti-hepatitis B virus activity TYMP, TYMS, PNP TYMS 2/4885LMNA 1140/4885SMN1; SMN2 4155/4885

“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.

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