Formic Acid Methyl Ester

Formic Acid Methyl Ester

SCHEMBL29281000

COC=O.Cc1ncccc1Br

nearest known ligand 0.40

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRIM24 O15164 1/20 0.40
▸ TRIM33 Q9UPN9 1/20 0.40
▸ HKDC1 Q2TB90 1/20 0.36
▸ PADI1 Q9ULC6 1/20 0.36
▸ PADI3 Q9ULW8 1/20 0.36
▸ PADI4 Q9UM07 1/20 0.36
▸ PADI2 Q9Y2J8 1/20 0.36
▸ ATG4B Q9Y4P1 1/20 0.36
▸ P2RX7 Q99572 1/20 0.35
▸ KEAP1 Q14145 1/20 0.34
▸ PKM P14618 1/20 0.33
▸ NFE2L2 Q16236 1/20 0.33
▸ MKNK1 Q9BUB5 1/20 0.33
▸ MKNK2 Q9HBH9 1/20 0.33
▸ DRD1 P21728 1/20 0.32
▸ NMT1 P30419 1/20 0.32
▸ CKS1B P61024 1/20 0.32
▸ SKP2 Q13309 1/20 0.32
▸ EDNRA P25101 2/20 0.32
▸ EDNRB P24530 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
SCHEMBL29067869 0.85 TRIM24 (0.42) TRIM24TRIM33P2RX7MKNK1MKNK2
SCHEMBL29653537 0.84 — —
SCHEMBL113672 0.84 — —
Ethoxycarbonyl Group SCHEMBL27868253 0.83 ALDH1A1 (0.36) TRIM24TRIM33P2RX7GRM4LMNA
Formaldehyde SCHEMBL29031592 0.82 P2RX7 (0.40) TRIM24TRIM33P2RX7MKNK1MKNK2
Bromide SCHEMBL31024397 0.82 — —
Bromide SCHEMBL18228015 0.82 — —
Dimethylformamide SCHEMBL27472098 0.81 TRIM24 (0.40) TRIM24TRIM33P2RX7MKNK1MKNK2
Cyanide SCHEMBL27870989 0.78 ALDH1A1 (0.37) TRIM24TRIM33P2RX7MKNK1MKNK2
Formic Acid Methyl Ester SCHEMBL28301958 0.78 TRIM24 (0.48) TRIM24TRIM33HKDC1PADI1PADI3

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
CN-119431314-A Substituted nitrogen-containing bicyclic compounds and uses thereof 广东东阳光药业股份有限公司 2025-02-14 — — CN disclosed
CN-117836294-A Biological antagonist containing aromatic ring, preparation method and application thereof 上海翰森生物医药科技有限公司 2024-04-05 — — CN disclosed
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