SCHEMBL20698322

SCHEMBL20698322

CCc1nn(C)c(-n2cnc3ccccc32)c1-c1ccc(F)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 2/20 0.40
▸ GRM2 Q14416 1/20 0.39
▸ FGFR1 P11362 2/20 0.36
▸ MKNK1 Q9BUB5 2/20 0.36
▸ MKNK2 Q9HBH9 2/20 0.36
▸ IGF1R P08069 2/20 0.35
▸ DPP4 P27487 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ CASP7 P55210 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.32

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
SCHEMBL20698165 0.86 HSD11B1 (0.44) HSD11B1GRM2FGFR1IGF1RDPP4
SCHEMBL20698323 0.84 HSD11B1 (0.43) HSD11B1GRM2FGFR1MKNK2IGF1R
SCHEMBL20698149 0.80 GRM2 (0.41) HSD11B1GRM2FGFR1MKNK1MKNK2
SCHEMBL20697928 0.78 HSD11B1 (0.41) HSD11B1FGFR1IGF1RDPP4
SCHEMBL20697930 0.78 HSD11B1 (0.41) HSD11B1DPP4
SCHEMBL20698122 0.77 FGFR1 (0.41) HSD11B1FGFR1MKNK2DPP4LMNA
SCHEMBL20698324 0.76 HSD11B1 (0.40) HSD11B1GRM2FGFR1MKNK1HTT
SCHEMBL20697939 0.75 MAPK1 (0.41) GRM2FGFR1DPP4HTTMAPK1
SCHEMBL20698028 0.75 FGFR1 (0.45) HSD11B1FGFR1DPP4LMNARAB9A
SCHEMBL20698134 0.73 HSD11B1 (0.41) HSD11B1IGF1RDPP4LMNAGAA

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
WO-2019020981-A1 PYRAZOLE, ISOTHIAZOLE AND ISOXAZOLE DERIVATIVES USEFUL AS AGRICULTURAL FUNGICIDES REDAG CROP PROTECTION LTD. (GB) 2019-01-31 — — WO disclosed
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