SCHEMBL29796757

SCHEMBL29796757

CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(Br)cc23)c1F

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 3/20 0.82
RIPK2 O43353 2/20 0.82
RAF1 P04049 2/20 0.82
KDR P35968 2/20 0.82
MAP2K2 P36507 2/20 0.82
TGFBR2 P37173 2/20 0.82
NEK2 P51955 2/20 0.82
MAP2K1 Q02750 2/20 0.82
TNK2 Q07912 2/20 0.82
MAP2K5 Q13163 2/20 0.82
PTK6 Q13882 2/20 0.82
NEK11 Q8NG66 2/20 0.82
MAP3K20 Q9NYL2 2/20 0.82
MAP4K5 Q9Y4K4 2/20 0.82
BMPR1B O00238 1/20 0.82
PLK4 O00444 1/20 0.82
PIR O00625 1/20 0.82
AURKA O14965 1/20 0.82
DCLK1 O15075 1/20 0.82
EPHB6 O15197 1/20 0.82

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
SCHEMBL294160 1.00 BRAF (0.82) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL299371 0.95 BRAF (0.73) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL7869149 0.94 BRAF (0.71) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL298054 0.91 BRAF (0.73) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL16066437 0.91 BRAF (0.68) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL299440 0.91 BRAF (0.73) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL298282 0.91 BRAF (0.84) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL20294639 0.90 BRAF (0.67) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL298349 0.90 BRAF (0.83) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL299672 0.90 BRAF (0.83) BRAFRIPK2RAF1KDRMAP2K2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121851005-A Synthesis method of N- [3- [ (5-bromo-1H-pyrrolo [2,3-B ] pyridin-3-yl) carbonyl ] -2, 4-difluorophenyl ] -1-propanesulfonamide 安徽大学 2026-04-14 CN disclosed
CN-121851005-A Synthesis method of N- [3- [ (5-bromo-1H-pyrrolo [2,3-B ] pyridin-3-yl) carbonyl ] -2, 4-difluorophenyl ] -1-propanesulfonamide 安徽大学 2026-04-14 CN disclosed
CN-112424201-B Protein kinase inhibitors that promote liver regeneration or reduce or prevent hepatocyte death 海帕瑞吉尼克斯股份有限公司 2024-04-02 CN disclosed
CN-110291089-B Protein kinase inhibitors for promoting liver regeneration or reducing or preventing liver cell death 海帕瑞吉尼克斯股份有限公司 2022-05-27 CN disclosed