SCHEMBL20698191

SCHEMBL20698191

COc1cccc2ncn(-c3c(-c4ccc(F)cc4Cl)c(C)nn3C)c12

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 1/20 0.45
▸ IGF1R P08069 3/20 0.39
▸ HSD11B1 P28845 2/20 0.39
▸ PDE2A O00408 5/20 0.38
▸ PDE10A Q9Y233 5/20 0.38
▸ PDE7A Q13946 1/20 0.38
▸ DPP4 P27487 1/20 0.36
▸ PDE6D O43924 1/20 0.36
▸ PDE6A P16499 1/20 0.36
▸ PDE6G P18545 1/20 0.36
▸ PDE6B P35913 1/20 0.36
▸ PDE6C P51160 1/20 0.36
▸ PDE6H Q13956 1/20 0.36
▸ POLB P06746 1/20 0.34
▸ ATP4A P20648 1/20 0.34
▸ ATP4B P51164 1/20 0.34
▸ CRHR1 P34998 1/20 0.34
▸ AMY1A P0DUB6 1/20 0.33

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
SCHEMBL20697929 0.90 HSD11B1 (0.40) FGFR1IGF1RHSD11B1PDE2APDE10A
SCHEMBL20698020 0.90 HSD11B1 (0.40) FGFR1IGF1RHSD11B1PDE2APDE10A
SCHEMBL20697956 0.89 HSD11B1 (0.36) FGFR1IGF1RHSD11B1DPP4
SCHEMBL20698160 0.88 HSD11B1 (0.37) FGFR1IGF1RHSD11B1PDE2APDE10A
SCHEMBL20698196 0.88 FGFR1 (0.39) FGFR1IGF1RHSD11B1PDE2APDE10A
SCHEMBL20698018 0.86 AR (0.38) IGF1RHSD11B1PDE2APDE10APDE7A
SCHEMBL20698192 0.84 FGFR1 (0.46) FGFR1PDE2APDE10APOLBATP4A
SCHEMBL20698165 0.83 HSD11B1 (0.44) FGFR1IGF1RHSD11B1PDE2APDE10A
SCHEMBL20698166 0.82 HSD11B1 (0.41) HSD11B1PDE2APDE10APDE7ADPP4
SCHEMBL20698155 0.82 HSD11B1 (0.40) IGF1RHSD11B1PDE2APDE10APDE7A

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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