SCHEMBL172378

SCHEMBL172378

O=C(OCC1OCCO1)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.52
KMT2A Q03164 2/20 0.50
MAPK1 P28482 1/20 0.50
HIF1A Q16665 1/20 0.50
CHRNB2 P17787 1/20 0.50
CHRNA5 P30532 1/20 0.50
CHRNA7 P36544 1/20 0.50
CHRNA4 P43681 1/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A3 Q01959 1/20 0.50
NPC1 O15118 2/20 0.49
LMNA P02545 1/20 0.49
ALDH1A1 P00352 1/20 0.49
PPM1B O75688 1/20 0.47
TSHR P16473 1/20 0.46
RAB9A P51151 1/20 0.46
MEN1 O00255 1/20 0.45
ATM Q13315 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
SCHEMBL21998228 0.87 TDP1 (0.46) TDP1KMT2AMAPK1HIF1ACHRNB2
SCHEMBL23808024 0.87 TDP1 (0.46) TDP1KMT2AMAPK1HIF1ACHRNB2
SCHEMBL711840 0.84 MAPK1 (0.44) TDP1KMT2AMAPK1HIF1ACHRNB2
SCHEMBL12959086 0.83 NPC1 (0.53) TDP1KMT2AMAPK1HIF1ACHRNB2
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL5604855 0.82 NPC1 (0.56) TDP1MAPK1HIF1ACHRNB2CHRNA5
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL14570069 0.82 NPC1 (0.56) TDP1MAPK1HIF1ACHRNB2CHRNA5
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL133986 0.82 NPC1 (0.56) TDP1MAPK1HIF1ACHRNB2CHRNA5
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL21245419 0.82 NPC1 (0.56) TDP1MAPK1HIF1ACHRNB2CHRNA5
SCHEMBL1931720 0.81 PPM1B (0.44) TDP1KMT2AMAPK1HIF1ACHRNB2
SCHEMBL7204759 0.81 TDP1 (0.50) TDP1KMT2AMAPK1HIF1ACHRNB2

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
US-8030338-B2 Method for producing 2-nitroimidazole derivative POLA PHARMA INC. (JP) 2011-10-04 US claimed
US-20230382931-A1 DIOXOLANE ANALOGUES OF URIDINE FOR THE TREATMENT OF CANCER MEDIVIR AB (SE) 2023-11-30 US disclosed
US-11731959-B2 Troxacitabine synthesis and crystal form thereof BEIJING HEBABIZ BIOTECHNOLOGY CO., INC. (CN) 2023-08-22 US disclosed
US-20230117570-A1 DIOXOLANE ANALOGUES OF URIDINE FOR THE TREATMENT OF CANCER MEDIVIR AB (SE) 2023-04-20 US disclosed
US-20210054008-A1 DIOXOLANE ANALOGUES OF URIDINE FOR THE TREATMENT OF CANCER MEDIVIR AB (SE) 2021-02-25 US disclosed
US-10822360-B2 Dioxolane analogues of uridine for the treatment of cancer MEDIVIR AB (SE) 2020-11-03 US disclosed
US-20200247787-A1 TROXACITABINE SYNTHESIS AND CRYSTAL FORM THEREOF BEIJING HEBABIZ BIOTECHNOLOGY CO., LTD. (CN) 2020-08-06 US disclosed
US-10654877-B2 Dioxolane analogues of uridine for the treatment of cancer MEDIVIR AB (SE) 2020-05-19 US disclosed
US-10336780-B2 Dioxolane analogues of uridine for the treatment of cancer MEDIVIR AB (SE) 2019-07-02 US disclosed
US-20190100541-A1 DIOXOLANE ANALOGUES OF URIDINE FOR THE TREATMENT OF CANCER MEDIVIR AB (SE) 2019-04-04 US disclosed
US-20170267705-A1 DIOXOLANE ANALOGUES OF URIDINE FOR THE TREATMENT OF CANCER MEDIVIR AB (SE) 2017-09-21 US disclosed
EP-1467990-B1 PROCESS FOR PRODUCING DIOXOLANE NUCLEOSIDE ANALOGUE PRECURSORS SHIRE BIOCHEM INC (CA) 2012-03-07 EP disclosed
US-7442813-B2 Process for producing dioxolane nucleoside analogues SHIRE BIOCHEM INC. (CA) 2008-10-28 US disclosed
US-20070197784-A1 Process for producing dioxolane nucleoside analogues TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-08-23 US disclosed
EP-1265890-B1 STEREOSELECTIVE SYNTHESIS OF NUCLEOSIDE ANALOGUES SHIRE BIOCHEM INC (CA) 2007-04-18 EP disclosed
US-5792773-A L-β-dioxolane uridine analog administration for treating Epstein-Barr virus infection YALE UNIVERSITY (US) 1998-08-11 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 (11 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-20190100541-A1 DIOXOLANE ANALOGUES OF URIDINE FOR THE TREATMENT OF CANCER ADORA3, DUT, NT5C TDP1 2014/4885KMT2A 3925/4885MAPK1 3170/4885
US-20230117570-A1 DIOXOLANE ANALOGUES OF URIDINE FOR THE TREATMENT OF CANCER ADORA3, DUT, NT5C TDP1 2102/4885KMT2A 4295/4885MAPK1 2844/4885
US-20170267705-A1 DIOXOLANE ANALOGUES OF URIDINE FOR THE TREATMENT OF CANCER ADORA3, NT5C, DUT TDP1 1878/4885KMT2A 4244/4885MAPK1 2979/4885
US-11731959-B2 Troxacitabine synthesis and crystal form thereof TBXAS1, TTPA, TBCB TDP1 1851/4885KMT2A 1609/4885MAPK1 3959/4885
US-10654877-B2 Dioxolane analogues of uridine for the treatment of cancer ADORA3, DUT, NTPCR TDP1 2000/4885KMT2A 4335/4885MAPK1 2890/4885
US-10336780-B2 Dioxolane analogues of uridine for the treatment of cancer ADORA3, DUT, NT5C TDP1 2002/4885KMT2A 4335/4885MAPK1 3026/4885
US-20200247787-A1 TROXACITABINE SYNTHESIS AND CRYSTAL FORM THEREOF TBXAS1, TTPA, TBCB TDP1 1851/4885KMT2A 1609/4885MAPK1 3959/4885
US-20210054008-A1 DIOXOLANE ANALOGUES OF URIDINE FOR THE TREATMENT OF CANCER ADORA3, DUT, NTPCR TDP1 2000/4885KMT2A 4335/4885MAPK1 2890/4885
US-20230382931-A1 DIOXOLANE ANALOGUES OF URIDINE FOR THE TREATMENT OF CANCER ADORA3, DUT, NTPCR TDP1 2000/4885KMT2A 4335/4885MAPK1 2890/4885
US-20070197784-A1 Process for producing dioxolane nucleoside analogues NUDT1, DPYD, DUT TDP1 565/4885KMT2A 4173/4885MAPK1 902/4885
US-10822360-B2 Dioxolane analogues of uridine for the treatment of cancer ADORA3, DUT, NTPCR TDP1 2000/4885KMT2A 4335/4885MAPK1 2890/4885

“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.