SCHEMBL3733635

SCHEMBL3733635

COc1ccc(COC(=O)c2ccc(=O)[nH]c2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.60
MMP9 P14780 2/20 0.56
MMP1 P03956 1/20 0.56
ALDH1A1 P00352 3/20 0.51
RAB9A P51151 3/20 0.50
NPC1 O15118 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
MAPT P10636 2/20 0.50
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
MMP2 P08253 1/20 0.49
MMP12 P39900 1/20 0.49
POLB P06746 2/20 0.49
ESR2 Q92731 1/20 0.46
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
HSD17B10 Q99714 1/20 0.45

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
SCHEMBL16689961 0.83 KMT2A (0.67) LMNAMMP9MMP1ALDH1A1RAB9A
SCHEMBL4252766 0.82 KMT2A (0.62) LMNAMMP9MMP1ALDH1A1RAB9A
SCHEMBL31197981 0.82 MMP9 (0.51) MMP9MMP1ALDH1A1RAB9ANPC1
SCHEMBL1129093 0.79 MEN1 (0.77) LMNAMMP9MMP1ALDH1A1RAB9A
SCHEMBL16880865 0.79 SMN1; SMN2 (0.44) LMNAMMP9MMP1ALDH1A1RAB9A
SCHEMBL27881866 0.78 MAPT (0.60) LMNAMMP9MMP1ALDH1A1RAB9A
SCHEMBL16704815 0.78 MAPT (0.60) LMNAMMP9MMP1ALDH1A1RAB9A
SCHEMBL10636593 0.78 NPC1 (0.71) LMNAMMP9MMP1ALDH1A1RAB9A
SCHEMBL15513889 0.77 LMNA (0.53) LMNAMMP9MMP1ALDH1A1RAB9A
SCHEMBL15508688 0.77 LMNA (0.53) LMNAMMP9MMP1ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7825238-B2 Antiviral methods employing double esters of 2′, 3′-dideoxy-3′-fluoroguanosine MEDIVIR AB (SE) 2010-11-02 US disclosed
US-7071173-B2 Antiviral methods employing double esters of 2′, 3′-dideoxy-3′-fluoroguanosine MEDIVIR AB (SE) 2006-07-04 US disclosed
US-20060122383-A1 Antiviral methods employing double esters of 2', 3'-dideoxy-3'-fluoroguanosine MEDIVIR AB (SE) 2006-06-08 US disclosed
US-20060058259-A1 ANTIVIRAL METHODS EMPLOYING DOUBLE ESTERS OF 2', 3'-DIDEOXY-3'-FLUOROGUANOSINE MEDIVIR AB (SE) 2006-03-16 US disclosed
US-6974802-B2 Treatment of viral infections using prodrugs of 2′,3-dideoxy,3′-fluoroguanosine MEDIVIR AB (SE) 2005-12-13 US disclosed
US-20030186924-A1 Prodrugs MEDIVIR AB 2003-10-02 US disclosed
US-6458772-B1 Prodrugs MEDIVIR AB (SE) 2002-10-01 US disclosed
US-20020128301-A1 Non-nucleoside reverse transcriptase inhibitors AB, Medivir (SE) 2002-09-12 US disclosed
EP-1150956-A1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MEDIVIR AB (SE) 2001-11-07 EP disclosed
EP-1121366-A1 PRODRUGS OF PHOSPHOROUS-CONTAINING PHARMACEUTICALS MEDIVIR AB (SE) 2001-08-08 EP disclosed
EP-1054891-A1 PRODRUGS MEDIVIR AB (SE) 2000-11-29 EP disclosed
WO-2000047561-A1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MEDIVIR AB (SE) 2000-08-17 WO disclosed
WO-1999051613-A1 PRODRUGS OF PHOSPHOROUS-CONTAINING PHARMACEUTICALS MEDIVIR AB (SE) 1999-10-14 WO disclosed
WO-1999041275-A1 PRODRUGS MEDIVIR AB (SE) 1999-08-19 WO 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 (4 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-20060058259-A1 ANTIVIRAL METHODS EMPLOYING DOUBLE ESTERS OF 2', 3'-DIDEOXY-3'-FLUOROGUANOSINE UNG, HAVCR2, EIF2AK2 LMNA 2899/4885MMP9 936/4885MMP1 2347/4885
US-20030186924-A1 Prodrugs HAVCR2, CYP7A1, IGSF11 LMNA 2190/4885MMP9 2008/4885MMP1 2387/4885
US-20060122383-A1 Antiviral methods employing double esters of 2', 3'-dideoxy-3'-fluoroguanosine UNG, HAVCR2, EIF2AK2 LMNA 2899/4885MMP9 936/4885MMP1 2347/4885
US-20020128301-A1 Non-nucleoside reverse transcriptase inhibitors SUB1, CBR1, GAR1 LMNA 1911/4885MMP9 2433/4885MMP1 1381/4885

“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.