SCHEMBL11054518

SCHEMBL11054518

CCCc1nc(C)c(C(=O)C(C)=O)[nH]1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.35
GLA P06280 1/20 0.35
POLB P06746 1/20 0.33
KDM4C Q9H3R0 1/20 0.32
GPR84 Q9NQS5 5/20 0.31
KDM4E B2RXH2 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPT P10636 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
SCHEMBL11000182 0.86 GLA (0.37) MAPK1GLAPOLBKDM4CGPR84
SCHEMBL11055751 0.81 GLA (0.34) GLAPOLBKDM4CGPR84KDM4E
SCHEMBL11050960 0.81 GLA (0.36) MAPK1GLAPOLBKDM4CGPR84
SCHEMBL5990880 0.81 MAPK1 (0.39) MAPK1GLAPOLBKDM4CGPR84
SCHEMBL11051550 0.79 MAPK1 (0.35) MAPK1GLAPOLBKDM4CGPR84
SCHEMBL5809049 0.78 ALDH1A1 (0.47) MAPK1POLBKDM4EKMT2AMAPT
SCHEMBL11054732 0.76 ALDH1A1 (0.40) MAPK1GPR84MAPT
SCHEMBL11053635 0.76 FFAR1 (0.39) MAPK1GLAPOLBKDM4CGPR84
SCHEMBL27295654 0.72 MAPK1 (0.36) MAPK1GLAKDM4E
SCHEMBL8903726 0.71 MAPK1 (0.35) MAPK1GLAKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4459413-A Process for preparing 5-imidazolyl ketones AMERICAN CYANAMID COMPANY (US) 1984-07-10 US disclosed
US-4395547-A Process for preparing 1-substituted-6-n-propyl-8-methylimidazo[1,5-d]-as-triazin-4(3H)-ones AMERICAN CYANAMID CO. (US) 1983-07-26 US disclosed