SCHEMBL6856427

SCHEMBL6856427

NC(=O)c1cncnc1Cl

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIRT3 Q9NTG7 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
RPS6KB1 P23443 8/20 0.40
NNMT P40261 2/20 0.40
SIRT6 Q8N6T7 1/20 0.39
SYK P43405 1/20 0.38
CASP1 P29466 3/20 0.38
AKT1 P31749 3/20 0.37
ADORA3 P0DMS8 1/20 0.36
TSHR P16473 1/20 0.36
MC4R P32245 1/20 0.36
ADRA1A P35348 1/20 0.36
MC3R P41968 1/20 0.36
MKNK1 Q9BUB5 1/20 0.36
MKNK2 Q9HBH9 1/20 0.36
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL1344662 0.81 SMN1; SMN2 (0.48) TDP1CASP1TSHRLMNASMN1; SMN2
SCHEMBL4826147 0.81 LMNA (0.35) SIRT6LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL4826150 0.79 SMN1; SMN2 (0.47) TDP1CASP1TSHRLMNASMN1; SMN2
SCHEMBL3705950 0.79 SMN1; SMN2 (0.34) TDP1LMNASMN1; SMN2
SCHEMBL23001626 0.79 CDC25B (0.34) LMNASMN1; SMN2
SCHEMBL3663171 0.77 SIRT3 (0.42) SIRT3TDP1RPS6KB1NNMTSYK
SCHEMBL31132417 0.77 SIRT3 (0.42) SIRT3TDP1RPS6KB1NNMTSYK
SCHEMBL626513 0.77 SIRT3 (0.42) SIRT3TDP1RPS6KB1NNMTSYK
SCHEMBL24166309 0.75 SIRT3 (0.50) SIRT3TDP1RPS6KB1NNMTSYK
SCHEMBL8828506 0.75 PIK3C3 (0.41) TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2004238361-A PYRIMIDINE-5-CARBOXAMIDE DERIVATIVE, ITS INTERMEDIATE AND METHOD FOR PRODUCING THE SAME TOSOH CORP 2004-08-26 JP disclosed