Formic Acid

Formic Acid

SCHEMBL2283605

COc1cccc(Nc2cccc(C3(c4ccc(OC(C)C)c(C)c4)COC(N)=N3)c2)c1.O=CO

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 13/20 0.43
CTSD P07339 8/20 0.43
MTNR1B P49286 4/20 0.37
NPC1 O15118 1/20 0.36
GAA P10253 1/20 0.36
GFER P55789 1/20 0.36
MTNR1A P48039 2/20 0.35
EGFR P00533 1/20 0.34
ERBB3 P21860 1/20 0.34
HTR2B P41595 1/20 0.34

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
SCHEMBL2283313 0.95 BACE1 (0.47) BACE1CTSDMTNR1BEGFRERBB3
Formic Acid SCHEMBL2285120 0.89 BACE1 (0.43) BACE1CTSDMTNR1BNPC1GAA
Formic Acid SCHEMBL2283640 0.86 BACE1 (0.57) BACE1CTSDMTNR1BNPC1GAA
SCHEMBL2283610 0.85 MTNR1B (0.35) BACE1CTSDMTNR1BNPC1MTNR1A
Formic Acid SCHEMBL2283961 0.84 BACE1 (0.52) BACE1CTSDMTNR1BNPC1GAA
SCHEMBL2279753 0.83 BACE1 (0.47) BACE1CTSDMTNR1BEGFRERBB3
Formic Acid SCHEMBL13685480 0.81 BACE1 (0.58) BACE1CTSD
SCHEMBL2282997 0.80 BACE1 (0.64) BACE1CTSDNPC1HTR2B
SCHEMBL2283004 0.80 BACE1 (0.64) BACE1CTSDNPC1HTR2B
SCHEMBL13825332 0.80 BACE1 (0.46) BACE1MTNR1BGAAMTNR1AEGFR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2245019-B1 4, 5-DIHYDRO-OXAZOL-2-YL AMINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2012-11-14 EP disclosed
US-7989449-B2 4,5-dihydro-oxazol-2-yl amine derivatives HOFFMAN-LA ROCHE INC. (US) 2011-08-02 US disclosed
US-20090209529-A1 4,5-DIHYDRO-OXAZOL-2-YL AMINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-08-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090209529-A1 4,5-DIHYDRO-OXAZOL-2-YL AMINE DERIVATIVES BACE2, BACE1, PSEN2 BACE1 2/4885CTSD 721/4885MTNR1B 664/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.