SCHEMBL14219129

SCHEMBL14219129

CCCCC(=O)OC1Cn2c(-c3ccnc(SC)n3)c(-c3ccc(F)cc3)c(=O)n2C1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 19/20 0.41
MAPK13 O15264 18/20 0.41
MAPK12 P53778 18/20 0.41
MAPK11 Q15759 18/20 0.41
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
CSNK1E P49674 1/20 0.38
CDK5 Q00535 1/20 0.38
CDK5R1 Q15078 1/20 0.38

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
SCHEMBL6683916 0.88 MAPK14 (0.44) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4852240 0.85 MAPK14 (0.48) MAPK14MAPK13MAPK12MAPK11CCNA2
SCHEMBL14294145 0.84 MAPK14 (0.49) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4859070 0.83 MAPK14 (0.46) MAPK14MAPK13MAPK12MAPK11CCNA2
SCHEMBL14294638 0.83 MAPK14 (0.46) MAPK14MAPK13MAPK12MAPK11CCNA2
SCHEMBL4861470 0.78 MAPK14 (0.46) MAPK14MAPK13MAPK12MAPK11CCNA2
SCHEMBL4227024 0.74 MAPK13 (0.66) MAPK14MAPK13MAPK12MAPK11
SCHEMBL14219128 0.71 USP2 (0.35) MAPK14
SCHEMBL4858007 0.71 MAPK13 (0.47) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6204650 0.70 MAPK13 (0.49) MAPK14MAPK13MAPK12MAPK11

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-7368455-B2 6,7-Dihydro-5H-pyrazolo[1,2-a]pyrazol-1-ones which control inflammatory cytokines THE PROCTER & GAMBLE COMPANY (US) 2008-05-06 US disclosed
US-7326714-B2 6,7-Dihydro-5H-pyrazolo[1,2-a]pyrazol-1-ones which control inflammatory cytokines THE PROCTER & GAMBLE COMPANY (US) 2008-02-05 US disclosed