SCHEMBL9513541

SCHEMBL9513541

Nc1[nH]c(=O)[nH]c(=O)c1NC=O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.44
TYMP P19971 6/20 0.43
PNP P00491 1/20 0.43
ALDH1A1 P00352 1/20 0.41
CYP2C19 P33261 1/20 0.41
G6PD P11413 1/20 0.34
RPS6KA3 P51812 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
MAPT P10636 1/20 0.31

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
SCHEMBL20008064 0.72 ALDH1A1 (0.36) TYMPALDH1A1CYP2C19
SCHEMBL17787656 0.71 TYMP (0.38) TYMPPNPALDH1A1CYP2C19RPS6KA3
SCHEMBL26980449 0.69 GAA (0.54) GAATYMPPNPG6PDRPS6KA3
SCHEMBL17844454 0.68 ALDH1A1 (0.49) PNPALDH1A1CYP2C19MAPT
SCHEMBL7914803 0.68 ALDH1A1 (0.56) PNPALDH1A1CYP2C19MAPT
SCHEMBL3982774 0.68 GAA (0.57) GAATYMPPNPALDH1A1G6PD
SCHEMBL15331802 0.67 TYMP (0.48) GAATYMPPNPG6PDRPS6KA3
SCHEMBL8553879 0.67 ALDH1A1 (0.55) PNPALDH1A1CYP2C19MAPT
SCHEMBL4570273 0.66 ALDH1A1 (0.54) PNPALDH1A1CYP2C19MEN1KMT2A
SCHEMBL15384307 0.66 MEN1 (0.45) GAATYMPPNPALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0304004-B1 Process for the production of sodium purines BOEHRINGER INGELHEIM KG (DE) 1993-11-03 EP disclosed
CN-1017241-B PREPARATION OF URACIL COMPOUNDS SHANDONG XINHUA PHARMACEUTICAL (CN) 1992-07-01 CN disclosed
EP-0221996-B1 SUBSTITUTED 2,3-DIHYDRO-6-HYDROXY-PYRIMIDO [2,1-f] PURINE-4,8(1H,9H)-DIONES SCHERING CORPORATION (US) 1990-08-29 EP disclosed
US-4847377-A ANTIHYPERPROLIFERATIVE SKIN DISEASES SCHERING CORPORATION (US) 1989-07-11 US disclosed
US-4816458-A TOPICAL ADMINISTERING SCHERING CORPORATION (US) 1989-03-28 US disclosed
EP-0304004-A1 Process for the production of sodium purines BOEHRINGER INGELHEIM KG (DE) 1989-02-22 EP disclosed
CN-87101334-A Produce the method for uracil compounds 1988-02-10 CN disclosed
EP-0221996-A1 SUBSTITUTED 2,3-DIHYDRO-6-HYDROXY-PYRIMIDO [2,1-f] PURINE-4,8(1H,9H)-DIONES. SCHERING CORP (US) 1987-05-20 EP disclosed
EP-0107165-B1 SUBSTITUTED 9H-8-OXO-PYRIMIDO(2,1-F)PURINE-2,4-DIONES, PROCESS FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SCHERING CORPORATION (US) 1987-04-15 EP disclosed
WO-1986006724-A1 SUBSTITUTED 2,3-DIHYDRO-6-HYDROXY-PYRIMIDO AD2,1-f BD-PURINE-4,8(1H,9H)-DIONES SCHERING CORPORATION (US) 1986-11-20 WO disclosed
US-4569936-A Anti-inflammatory substituted 9H-8-oxo-pyrimido[2,1-f]purine-2,4-diones SCHERING CORPORATION (US) 1986-02-11 US disclosed
EP-0107165-A1 Substituted 9H-8-oxo-pyrimido(2,1-f)purine-2,4-diones, process for their production and pharmaceutical compositions containing them SCHERING CORPORATION (US) 1984-05-02 EP disclosed