SCHEMBL19218101

SCHEMBL19218101

CC(C)(O)C(C)(C)OBc1cnn(CCO)c1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KIT P10721 1/20 0.33
PDK2 Q15119 6/20 0.32
FGFR1 P11362 1/20 0.32
FGFR2 P21802 1/20 0.32
FGFR4 P22455 1/20 0.32
FGFR3 P22607 1/20 0.32
FFAR1 O14842 1/20 0.31
PDK1 Q15118 1/20 0.30
PDK3 Q15120 1/20 0.30

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
SCHEMBL21746615 0.86 LRRK2 (0.32) FFAR1
SCHEMBL13127914 0.85 FFAR1 (0.33) FFAR1
SCHEMBL15292346 0.84 FFAR1 (0.47) PDK2FGFR1FGFR2FGFR4FGFR3
SCHEMBL21746173 0.83 L3MBTL1 (0.30)
SCHEMBL19267190 0.82 PSMB1 (0.34) FGFR1FGFR2FGFR4FGFR3
SCHEMBL3401064 0.81 ERN1 (0.30)
SCHEMBL12179505 0.81 ACHE (0.43) PDK2FFAR1
SCHEMBL12332954 0.81 FFAR1 (0.36) FFAR1
SCHEMBL15885009 0.80 HRH3 (0.34)
SCHEMBL15504543 0.80 S1PR1 (0.36) FGFR1FGFR2FGFR3

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
EP-2864318-B1 2-AMINOPYRAZINE DERIVATIVES AS CSF-1R KINASE INHIBITORS MACROPHAGE PHARMA LTD (GB) 2017-08-09 EP disclosed