SCHEMBL7780833

SCHEMBL7780833

NC(=O)Oc1cncnc1O

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
TSHR P16473 1/20 0.31
MC4R P32245 1/20 0.31
ADRA1A P35348 1/20 0.31
MC3R P41968 1/20 0.31
HCAR2 Q8TDS4 1/20 0.30

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
SCHEMBL7787933 0.82 HCAR2 (0.35) HCAR2
SCHEMBL7785903 0.78 HSD17B10 (0.39) TSHR
SCHEMBL8983616 0.71
SCHEMBL16936162 0.70 MEN1 (0.33) MEN1KMT2A
SCHEMBL626513 0.69 SIRT3 (0.42) ADORA3TSHRMC4RADRA1AMC3R
SCHEMBL31132417 0.69 SIRT3 (0.42) ADORA3TSHRMC4RADRA1AMC3R
SCHEMBL19475045 0.69 MEN1 (0.39) MEN1KMT2A
SCHEMBL782969 0.69 MEN1 (0.37) MEN1KMT2AADORA3TSHRMC4R
SCHEMBL9978366 0.69 MEN1 (0.46) MEN1KMT2AADORA3TSHRMC4R
SCHEMBL9572481 0.68 DYRK1A (0.43) MEN1KMT2AADORA3TSHRMC4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0964855-B1 PROCESS FOR PREPARING SUBSTITUTED PYRIMIDINE DERIVATIVES LONZA AG (CH) 2001-10-17 EP disclosed
EP-0964855-A1 PROCESS FOR PREPARING SUBSTITUTED PYRIMIDINE DERIVATIVES LONZA A.G. (CH) 1999-12-22 EP disclosed
WO-1998030549-A1 PROCESS FOR PREPARING SUBSTITUTED PYRIMIDINE DERIVATIVES LONZA AG (CH) 1998-07-16 WO disclosed