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SCHEMBL19225939

SCHEMBL19225939

CCCCc1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)n3)c3ccccc23)n(-c2ccc(OC)cc2)n1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GSK3A P49840 15/20 0.76
▸ MAPK14 Q16539 12/20 0.76
▸ MAPK12 P53778 5/20 0.76
▸ SRC P12931 10/20 0.67
▸ SYK P43405 9/20 0.67
▸ HCK P08631 1/20 0.66
▸ GSK3B P49841 1/20 0.66

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
SCHEMBL19226086 0.95 MAPK14 (0.77) GSK3AMAPK14MAPK12SRCSYK
SCHEMBL19226068 0.95 MAPK14 (0.77) GSK3AMAPK14MAPK12SRCSYK
SCHEMBL19750037 0.93 GSK3A (0.78) GSK3AMAPK14MAPK12SRCSYK
SCHEMBL19101997 0.93 MAPK14 (0.69) GSK3AMAPK14MAPK12SRCSYK
SCHEMBL19102036 0.92 MAPK14 (0.69) GSK3AMAPK14MAPK12SRCSYK
SCHEMBL19225942 0.92 MAPK14 (0.78) GSK3AMAPK14MAPK12SRCSYK
SCHEMBL19102044 0.91 MAPK14 (0.78) GSK3AMAPK14MAPK12SRCSYK
SCHEMBL19226007 0.91 MAPK14 (0.76) GSK3AMAPK14MAPK12SRCSYK
SCHEMBL19102027 0.91 SYK (0.82) GSK3AMAPK14MAPK12SRCSYK
SCHEMBL19226112 0.90 MAPK14 (0.80) GSK3AMAPK14MAPK12SRCSYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9724347-B2 1-pyrazolyl-3-(4-((2-anilinopyrimidin-4-yl)oxy)napththalen-1-yl) ureas as P38 MAP knase inhibitors Respivert, Ltd. 2017-08-08 — — US disclosed