Formic Acid

Formic Acid

SCHEMBL28293282

Cc1cc(O)c(C)c(O)c1.O=CO

nearest known ligand 0.74

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.74
SELL P14151 1/20 0.50
SELP P16109 1/20 0.50
SELE P16581 1/20 0.50
ERN1 O75460 2/20 0.46
CYP3A4 P08684 3/20 0.42
TRPA1 O75762 2/20 0.40
ALDH1A1 P00352 4/20 0.39
PIM1 P11309 3/20 0.39
DAO P14920 1/20 0.38
MAPT P10636 3/20 0.37
KMT2A Q03164 3/20 0.37
POLB P06746 2/20 0.37
APEX1 P27695 2/20 0.37
KDM4E B2RXH2 2/20 0.37
RECQL P46063 2/20 0.37
GAA P10253 1/20 0.37
MPI P34949 1/20 0.37
TDP1 Q9NUW8 3/20 0.36
MEN1 O00255 2/20 0.36

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
SCHEMBL69718 0.86 ACHE (1.00) ACHESELLSELPSELEERN1
Formaldehyde SCHEMBL10878707 0.83 ACHE (0.82) ACHESELLSELPSELEERN1
Formic Acid Methyl Ester SCHEMBL28225780 0.83 ACHE (0.64) ACHESELLSELPSELEERN1
Formic Acid SCHEMBL27757675 0.80 ALDH1A1 (0.50) ACHESELLSELPSELEERN1
SCHEMBL1981683 0.78 ERN1 (0.64) ACHESELLSELPSELEERN1
Orcinol SCHEMBL28132603 0.76 ALDH1A1 (0.63) ACHESELLSELPSELEERN1
Formic Acid SCHEMBL27402127 0.76 RAPGEF4 (0.43) ACHEERN1ALDH1A1MAPTKMT2A
Orcinol SCHEMBL8334005 0.76 ACHE (0.78) ACHESELLSELPSELECYP3A4
SCHEMBL3468910 0.74 KDM4E (0.52) ACHEERN1CYP3A4ALDH1A1KDM4E
Formic Acid SCHEMBL15532423 0.74 ALDH1A1 (0.52) SELLSELPSELEERN1CYP3A4

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-109666707-A Utilize method Aspergillus terreus bacterial strain production 4-O- demethyl barbatic acid and then synthesize synthesis oak moss 中国科学院青岛生物能源与过程研究所 2019-04-23 CN claimed