SCHEMBL19952769

SCHEMBL19952769

Fc1ccc(-c2nc(-c3ccc4ccccc4c3Br)[nH]c2-c2ccncc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 0.79
CSNK1D P48730 5/20 0.79
CSNK1E P49674 4/20 0.79
MAPK13 O15264 11/20 0.75
GCGR P47871 11/20 0.75
MAPK12 P53778 11/20 0.75
MAPK11 Q15759 11/20 0.75
ALOX5 P09917 5/20 0.66
PRKD3 O94806 1/20 0.61
MAP4K4 O95819 1/20 0.61
FRK P42685 1/20 0.61
MAPK9 P45984 1/20 0.61
CSNK1A1 P48729 1/20 0.61
GSK3B P49841 1/20 0.61
PTK6 Q13882 1/20 0.61
PRKD2 Q9BZL6 1/20 0.61
CLK4 Q9HAZ1 1/20 0.61

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
SCHEMBL17002321 0.88 MAPK14 (1.00) MAPK14CSNK1DCSNK1EMAPK13GCGR
SCHEMBL29465653 0.88 MAPK14 (1.00) MAPK14CSNK1DCSNK1EMAPK13GCGR
SCHEMBL2650029 0.86 MAPK14 (1.00) MAPK14CSNK1DCSNK1EMAPK13GCGR
SCHEMBL26677067 0.84 MAPK14 (0.74) MAPK14CSNK1DCSNK1EMAPK13GCGR
SCHEMBL6003680 0.82 MAPK14 (1.00) MAPK14CSNK1DCSNK1EMAPK13GCGR
SCHEMBL4563107 0.80 ALOX5 (1.00) MAPK14CSNK1DCSNK1EMAPK13GCGR
SCHEMBL17002317 0.79 MAPK14 (1.00) MAPK14CSNK1DCSNK1EMAPK13GCGR
SCHEMBL30197605 0.79 MAPK14 (1.00) MAPK14CSNK1DCSNK1EMAPK13GCGR
SCHEMBL6466496 0.79 NT5E (0.71) MAPK14CSNK1DCSNK1EMAPK13GCGR
SCHEMBL2648011 0.78 MAPK14 (0.76) MAPK14CSNK1DCSNK1EMAPK13GCGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3500562-B1 SUBSTITUTED AZOLE DERIVATIVES FOR GENERATION, PROLIFERATION AND DIFFERENTIATION OF HEMATOPOIETIC STEM AND PROGENITOR CELLS NAT UNIV SINGAPORE (SG) 2023-11-15 EP claimed
EP-3500562-A1 SUBSTITUTED AZOLE DERIVATIVES FOR GENERATION, PROLIFERATION AND DIFFERENTIATION OF HEMATOPOIETIC STEM AND PROGENITOR CELLS National University of Singapore (SG) 2019-06-26 EP claimed
WO-2018048346-A1 SUBSTITUTED AZOLE DERIVATIVES FOR GENERATION, PROLIFERATION AND DIFFERENTIATION OF HEMATOPOIETIC STEM AND PROGENITOR CELLS NATIONAL UNIVERSITY OF SINGAPORE (SG) 2018-03-15 WO claimed
EP-3500562-B1 SUBSTITUTED AZOLE DERIVATIVES FOR GENERATION, PROLIFERATION AND DIFFERENTIATION OF HEMATOPOIETIC STEM AND PROGENITOR CELLS NAT UNIV SINGAPORE (SG) 2023-11-15 EP disclosed
CN-109890805-B Substituted azole derivatives for the production, proliferation and differentiation of hematopoietic stem and progenitor cells 新加坡国立大学 2023-04-04 CN disclosed