SCHEMBL30900876

SCHEMBL30900876

N#Cc1cc(OC(F)F)cc(OC(F)F)c1F

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KCNN4 O15554 1/20 0.32
▸ EPAS1 Q99814 1/20 0.30
▸ SLC22A12 Q96S37 1/20 0.30
▸ CYP11B1 P15538 1/20 0.30
▸ CYP11B2 P19099 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ PKM P14618 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL30881834 0.80 KCNN4 (0.31) KCNN4CYP11B1CYP11B2
SCHEMBL29209725 0.80 ESR1 (0.35) KCNN4
SCHEMBL30881677 0.80 KCNN4 (0.33) KCNN4CYP11B1CYP11B2MEN1KMT2A
SCHEMBL29209812 0.80 KCNN4 (0.33) KCNN4CYP11B1CYP11B2MEN1KMT2A
SCHEMBL30881822 0.80 ESR1 (0.35) KCNN4
SCHEMBL3532342 0.73 CYP2D6 (0.40) KCNN4EPAS1SLC22A12CYP11B1CYP11B2
SCHEMBL30881806 0.72 KCNN4 (0.43) KCNN4SLC22A12KMT2A
SCHEMBL29209695 0.72 KCNN4 (0.43) KCNN4SLC22A12KMT2A
SCHEMBL21596788 0.71 TRPV4 (0.48) EPAS1MEN1PKMKMT2A
SCHEMBL3530578 0.70 FFAR1 (0.43) KCNN4EPAS1SLC22A12CYP11B1CYP11B2

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-2024099269-A1 ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, USE THEREOF 华东师范大学 2024-05-16 — — WO disclosed
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