SCHEMBL5513045

SCHEMBL5513045

[O]C(=S)Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.45
ATM Q13315 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
ALOX15 P16050 2/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RAD51 Q06609 1/20 0.41
LTA4H P09960 1/20 0.41
TSHR P16473 1/20 0.41
SRC P12931 1/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
NSD2 O96028 1/20 0.41
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
ELANE P08246 1/20 0.39
CA5A P35218 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL178607 0.78 LTA4H (0.45) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL2470101 0.78 LTA4H (0.45) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL3087192 0.78 LTA4H (0.45) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL9660788 0.77 TDP1 (0.48) TDP1ATML3MBTL1ALOX15HPGD
Bicarbonate SCHEMBL27833263 0.76 TDP1 (0.52) TDP1ATML3MBTL1ALOX15HPGD
Bicarbonate SCHEMBL21879667 0.76 TDP1 (0.52) TDP1ATML3MBTL1ALOX15HPGD
Bicarbonate SCHEMBL1393750 0.76 TDP1 (0.52) TDP1ATML3MBTL1ALOX15HPGD
Bicarbonate SCHEMBL9240263 0.76 TDP1 (0.52) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL11171421 0.76 LTA4H (0.43) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL55636 0.76 TDP1 (0.52) TDP1ATML3MBTL1ALOX15HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5952478-A Intermediates for dinucleotide and oligonucleotide analogues NOVARTIS FINANCE CORPORATION (US) 1999-09-14 US claimed
US-5670489-A USEFUL IN TREATMENT OF DISEASES WHICH ARE MODULATED BY PROTEINS, OR IN TREATMENT OF VIRUSES SUCH AS INFLUENZA, HERPES, AND HIV NOVARTIS CORPORATION (US) 1997-09-23 US claimed
EP-0778843-A1 INTERMEDIATES FOR DINUCLEOTIDE AND OLIGONUCLEOTIDE ANALOGUES Novartis AG (CH) 1997-06-18 EP claimed
US-5508270-A Nucleoside phosphinate compounds and compositions CIBA-GEIGY CORPORATION (US) 1996-04-16 US claimed
WO-1996008503-A1 INTERMEDIATES FOR DINUCLEOTIDE AND OLIGONUCLEOTIDE ANALOGUES NOVARTIS AG (CH) 1996-03-21 WO claimed
WO-1996007666-A1 MONONUCLEOTIDE AND DINUCLEOTIDE ANALOGUES AND INTERMEDIATES THEREFOR NOVARTIS AG (CH) 1996-03-14 WO claimed
US-5466677-A Dinucleoside phosphinates and their pharmaceutical compositions CIBA-GEIGY CORPORATION (US) 1995-11-14 US claimed
EP-0629633-A2 Dinucleotide analogues, intermediates therefor and oligonucleotides derived therefrom CIBA-GEIGY AG (CH) 1994-12-21 EP claimed
EP-0614906-A1 Mononucleotide analogues and intermediates therefor CIBA-GEIGY AG (CH) 1994-09-14 EP claimed
EP-0614907-A1 Dinucleotide and oligonucleotide analogues CIBA-GEIGY AG (CH) 1994-09-14 EP claimed
JP-10298186-A None JP disclosed
US-7157442-B2 Antibacterial compound SANKYO COMPANY, LIMITED (JP) 2007-01-02 US disclosed
US-6930104-B2 Heterocyclic derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-08-16 US disclosed
US-20040157850-A1 Novel heterocyclic derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-08-12 US disclosed
EP-1209166-B1 NOVEL A-500359 DERIVATIVES SANKYO CO (JP) 2004-03-31 EP disclosed
EP-0614906-A1 Mononucleotide analogues and intermediates therefor CIBA-GEIGY AG (CH) 1994-09-14 EP disclosed
WO-1993006112-A1 THERAPEUTIC NUCLEOSIDES THE WELLCOME FOUNDATION LIMITED (GB) 1993-04-01 WO disclosed
EP-0120374-B1 2-DESOXYOXANOSINE, A PROCESS FOR THE PREPARATION THEREOF AND ITS USE AS A MEDICAMENT MICROBIAL CHEMISTRY RESEARCH FOUNDATION (JP) 1986-12-30 EP disclosed
US-4530998-A 2'-Deoxyoxanosine ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYUKAI (JP) 1985-07-23 US disclosed
EP-0120374-A1 2-Desoxyoxanosine, a process for the preparation thereof and its use as a medicament MICROBIAL CHEMISTRY RESEARCH FOUNDATION (JP) 1984-10-03 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 (1 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-20040157850-A1 Novel heterocyclic derivatives APP, BACE1, PSEN1 TDP1 843/4885ATM 1822/4885L3MBTL1 4646/4885

“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.