SCHEMBL20698192

SCHEMBL20698192

COc1cc(F)c(-c2c(C)nn(C)c2-n2cnc3cccc(OC)c32)c(F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 2/20 0.46
▸ HTT P42858 3/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ GFER P55789 1/20 0.38
▸ PDE2A O00408 3/20 0.38
▸ PDE10A Q9Y233 3/20 0.38
▸ GRM8 O00222 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ GRM7 Q14831 1/20 0.35
▸ MAPT P10636 2/20 0.35
▸ PSEN1 P49768 2/20 0.34
▸ PSEN2 P49810 2/20 0.34
▸ APH1B Q8WW43 2/20 0.34
▸ NCSTN Q92542 2/20 0.34
▸ APH1A Q96BI3 2/20 0.34
▸ PSENEN Q9NZ42 2/20 0.34
▸ ATP4A P20648 1/20 0.33
▸ ATP4B P51164 1/20 0.33
▸ POLB P06746 2/20 0.33
▸ LMNA P02545 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
SCHEMBL20698191 0.84 FGFR1 (0.45) FGFR1PDE2APDE10AATP4AATP4B
SCHEMBL20697990 0.83 FGFR1 (0.39) FGFR1HTTALDH1A1PDE2APDE10A
SCHEMBL20698206 0.83 PDE10A (0.39) FGFR1HTTALDH1A1GFERPDE2A
SCHEMBL20698117 0.80 PDE2A (0.39) PDE2APDE10AGRM8CYP1A2GRM7
SCHEMBL20697994 0.80 FGFR1 (0.48) FGFR1HTTALDH1A1PDE2APDE10A
SCHEMBL20698121 0.79 FGFR1 (0.41) FGFR1HTTALDH1A1PDE2APDE10A
SCHEMBL20697961 0.79 PDE2A (0.44) FGFR1ALDH1A1PDE2APDE10AGRM8
SCHEMBL20698301 0.77 SIK1 (0.41) FGFR1HTTALDH1A1PDE2APDE10A
SCHEMBL20698298 0.77 FGFR1 (0.38) FGFR1HTTALDH1A1PDE2APDE10A
SCHEMBL20697997 0.77 FGFR1 (0.40) FGFR1ALDH1A1PDE2APDE10AGRM8

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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