SCHEMBL29138802

SCHEMBL29138802

CC(C)(O)c1c(F)cccc1Oc1cnc2c(CF)cccc2c1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.37
▸ EGLN1 Q9GZT9 1/20 0.33
▸ FFAR4 Q5NUL3 1/20 0.31
▸ MAOB P27338 1/20 0.30
▸ FFAR1 O14842 1/20 0.30
▸ GCK P35557 1/20 0.30
▸ CYP11B1 P15538 1/20 0.30
▸ CYP11B2 P19099 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ PPARG P37231 1/20 0.30
▸ HTR2C P28335 1/20 0.30
▸ MCHR1 Q99705 1/20 0.30
▸ HPGDS O60760 2/20 0.30
▸ BACE1 P56817 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
SCHEMBL12487949 0.89 EGLN1 (0.34) KDM4EEGLN1GCKCYP11B1CYP11B2
SCHEMBL30451840 0.85 EGLN1 (0.33) KDM4EEGLN1GCKCYP11B1CYP11B2
SCHEMBL12489724 0.83 EGLN1 (0.37) KDM4EEGLN1MAOBFFAR1GCK
SCHEMBL12489581 0.80 EGLN1 (0.35) KDM4EEGLN1GCKCYP11B1CYP11B2
SCHEMBL29777482 0.80 EGLN1 (0.35) KDM4EEGLN1GCKCYP11B1CYP11B2
SCHEMBL13684923 0.79 EGLN1 (0.33) KDM4EEGLN1CYP11B1CYP11B2HPGDS
SCHEMBL20506407 0.77 MAOB (0.39) EGLN1MAOBCYP3A4PPARGHTR2C
SCHEMBL20577271 0.76 GCK (0.36) EGLN1GCKCYP11B1CYP11B2
SCHEMBL22372365 0.73 KDM4E (0.44) KDM4EEGLN1
SCHEMBL12489524 0.72 EGLN1 (0.36) EGLN1HPGDS

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
CN-117177963-A Microbiocidal quinoline/quinoxaline isoquinoline derivatives 先正达农作物保护股份公司 2023-12-05 — — CN disclosed
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