SCHEMBL8997976

SCHEMBL8997976

O=c1[nH]cc([Hg]Cl)c(=O)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DPYD Q12882 5/20 0.46
▸ MAPT P10636 3/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ GAA P10253 2/20 0.46
▸ ATAD2 Q6PL18 1/20 0.46
▸ CYP19A1 P11511 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ THPO P40225 1/20 0.46
▸ MTOR P42345 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ HBB P68871 1/20 0.46
▸ PMP22 Q01453 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ KDM4C Q9H3R0 1/20 0.37

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
SCHEMBL67366 0.69 — —
SCHEMBL65085 0.69 — —
SCHEMBL5801644 0.67 ALDH1A1 (0.64) DPYDMAPTALDH1A1LMNAGAA
Hydrochloric Acid SCHEMBL29256236 0.67 DPYD (0.50) DPYDMAPTALDH1A1LMNAGAA
SCHEMBL18783134 0.67 DPYD (0.50) DPYDMAPTALDH1A1LMNAGAA
Potassium SCHEMBL29524710 0.67 DPYD (0.50) DPYDMAPTALDH1A1LMNAGAA
SCHEMBL6573722 0.65 — —
SCHEMBL2584919 0.64 LMNA (0.52) DPYDMAPTALDH1A1LMNAGAA
SCHEMBL8537479 0.64 MAPT (0.52) DPYDMAPTALDH1A1LMNAGAA
SCHEMBL11417188 0.64 DPYD (0.46) DPYDMAPTALDH1A1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5521163-A TREATMENT OF HERPES VIRUS WITH 1'-DEOXY-5-ETHYL-4'-THIO-BETA URIDINE UNIVERSITY OF BIRMINGHAM (GB) 1996-05-28 — — US disclosed
EP-0658166-A1 ANTIVIRAL PYRIMIDINE NUCLEOSIDES THE UNIVERSITY OF BIRMINGHAM (GB) 1995-06-21 — — EP disclosed
US-5356882-A Treating herpes virus UNIVERSITY OF BIRMINGHAM (GB) 1994-10-18 — — US disclosed
WO-1994005687-A1 ANTIVIRAL PYRIMIDINE NUCLEOSIDES UNIVERSITY OF BIRMINGHAM (GB) 1994-03-17 — — WO disclosed
WO-1991001326-A1 ANTIVIRAL PYRIMIDINE NUCLEOSIDES UNIVERSITY OF BIRMINGHAM (GB) 1991-02-07 — — WO disclosed
EP-0409575-A1 Antiviral pyrimidine nucleosides THE UNIVERSITY OF BIRMINGHAM (GB) 1991-01-23 — — EP disclosed
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