SCHEMBL6471464

SCHEMBL6471464

CNC(=O)c1ccc(C)c(-c2c(C)[nH]c(=O)c(Br)c2OCc2ccc(F)cc2F)c1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.55
ROCK2 O75116 1/20 0.55
MAPK12 P53778 1/20 0.55
MAPK11 Q15759 1/20 0.55
STRADA Q7RTN6 1/20 0.55
PTGER1 P34995 2/20 0.46
MAOB P27338 1/20 0.40

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
SCHEMBL6473202 0.94 MAPK14 (0.49) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL6471751 0.92 MAPK14 (0.55) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL6471517 0.92 MAPK14 (0.51) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL6471677 0.91 MAPK14 (0.46) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL6471285 0.91 MAPK14 (0.55) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL6474194 0.91 MAPK14 (0.49) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL6471760 0.90 MAPK14 (0.53) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL6474423 0.90 MAPK14 (0.44) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL6474664 0.90 MAPK14 (0.49) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL4386716 0.90 MAPK14 (0.56) MAPK14ROCK2MAPK12MAPK11STRADA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021216754-A1 USE OF P38 MAPK INHIBITORS FOR PREVENTION AND TREATMENT OF AGING AND AGING-RELATED DISORDERS AND FOR BOOSTING AN IMMUNE SYSTEM Spring Discovery, Inc. (US) 2021-10-28 WO disclosed
EP-3429603-A1 METHODS AND COMPOSITIONS RELATING TO HEMATOPOIETIC STEM CELL EXPANSION Children's Medical Center Corporation (US) 2019-01-23 EP disclosed
EP-3313420-A1 METHODS AND COMPOSITIONS RELATING TO HEMATOPOIETIC STEM CELL EXPANSION, ENRICHMENT, AND MAINTENANCE Children's Medical Center Corporation (US) 2018-05-02 EP disclosed
WO-2017161001-A1 METHODS AND COMPOSITIONS RELATING TO HEMATOPOIETIC STEM CELL EXPANSION CHILDREN'S MEDICAL CENTER CORPORATION (US) 2017-09-21 WO disclosed
WO-2016210292-A1 METHODS AND COMPOSITIONS RELATING TO HEMATOPOIETIC STEM CELL EXPANSION, ENRICHMENT, AND MAINTENANCE CHILDREN'S MEDICAL CENTER CORPORATION (US) 2016-12-29 WO disclosed
WO-2005018557-A2 SUBSTITUTED PYRIDINONES PHARMACIA CORPORATION (US) 2005-03-03 WO disclosed