SCHEMBL20680752

SCHEMBL20680752

Cc1nn(C)c(-n2cnc3cc(N(C)C)cc(F)c32)c1-c1ccc(F)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.38
DPP4 P27487 2/20 0.33
PDE2A O00408 2/20 0.32
PDE10A Q9Y233 2/20 0.32
PDE7A Q13946 1/20 0.32
SLC34A1 Q06495 2/20 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
SCHEMBL20698166 0.89 HSD11B1 (0.41) HSD11B1DPP4PDE2APDE10APDE7A
SCHEMBL20697946 0.86 HSD11B1 (0.39) HSD11B1DPP4PDE2APDE10APDE7A
SCHEMBL20697996 0.85 HSD11B1 (0.36) HSD11B1DPP4PDE2APDE10APDE7A
SCHEMBL20697929 0.84 HSD11B1 (0.40) HSD11B1DPP4PDE2APDE10APDE7A
SCHEMBL20697993 0.82 PTPN11 (0.38) HSD11B1DPP4
SCHEMBL20698295 0.81 HSD11B1 (0.40) HSD11B1DPP4PDE2APDE10APDE7A
SCHEMBL20698020 0.80 HSD11B1 (0.40) HSD11B1DPP4PDE2APDE10APDE7A
SCHEMBL20698027 0.80 DPP4 (0.40) HSD11B1DPP4PDE2APDE10A
SCHEMBL20697928 0.79 HSD11B1 (0.41) HSD11B1DPP4PDE2APDE10APDE7A
SCHEMBL20697930 0.79 HSD11B1 (0.41) HSD11B1DPP4PDE2APDE10APDE7A

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