SCHEMBL799499

SCHEMBL799499

Cc1ccc(NC(=O)OF)cc1NC(=O)Oc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.54
MAPT P10636 4/20 0.54
CYP1A2 P05177 1/20 0.52
KDM4E B2RXH2 3/20 0.51
POLB P06746 1/20 0.51
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
THRB P10828 1/20 0.50
GFER P55789 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
LMNA P02545 3/20 0.49
GAA P10253 3/20 0.49
TP53 P04637 1/20 0.49
RAD51 Q06609 1/20 0.49
MAPK1 P28482 2/20 0.48
FAAH O00519 1/20 0.48
CYP3A4 P08684 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL989117 0.93 ALDH1A1 (0.60) ALDH1A1MAPTCYP1A2KDM4EPOLB
SCHEMBL15374817 0.89 ALDH1A1 (0.60) ALDH1A1MAPTCYP1A2KDM4EPOLB
SCHEMBL13859992 0.88 ALDH1A1 (0.55) ALDH1A1MAPTCYP1A2KDM4EPOLB
SCHEMBL13104381 0.88 MAPT (0.54) ALDH1A1MAPTCYP1A2KDM4EPOLB
SCHEMBL13593024 0.88 MAPT (0.57) ALDH1A1MAPTCYP1A2KDM4EPOLB
SCHEMBL13104382 0.86 MAPT (0.52) ALDH1A1MAPTCYP1A2KDM4EPOLB
SCHEMBL25342944 0.85 ALDH1A1 (0.51) ALDH1A1MAPTCYP1A2KDM4EPOLB
SCHEMBL1952563 0.85 PORCN (0.60) ALDH1A1MAPTCYP1A2KDM4EPOLB
SCHEMBL13104359 0.85 MAPT (0.55) ALDH1A1MAPTCYP1A2KDM4EPOLB
SCHEMBL13104406 0.85 MAPT (0.58) ALDH1A1MAPTCYP1A2KDM4EPOLB

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
US-8318656-B2 Production processes and systems, compositions, surfactants, monomer units, metal complexes, phosphate esters, glycols, aqueous film forming foams, and foam stabilizers E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-11-27 US disclosed
US-20120071689-A1 PRODUCTION PROCESSES AND SYSTEMS, COMPOSITIONS, SURFACTANTS, MONOMER UNITS, METAL COMPLEXES, PHOSPHATE ESTERS, GLYCOLS, AQUEOUS FILM FORMING FOAMS, AND FOAM STABILIZERS E.I. DU PONT DE NEMOURS AND COMPANY CHEMTURA CORPORATION (US) 2012-03-22 US disclosed
US-7943567-B2 Production processes and systems, compositions, surfactants, monomer units, metal complexes, phosphate esters, glycols, aqueous film forming foams, and foam stabilizers E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-05-17 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-20120071689-A1 PRODUCTION PROCESSES AND SYSTEMS, COMPOSITIONS, SURFACTANTS, MONOMER UNITS, METAL COMPLEXES, PHOSPHATE ESTERS, GLYCOLS, AQUEOUS FILM FORMING FOAMS, AND FOAM STABILIZERS FOS, AFF4, AFF1 ALDH1A1 869/4885MAPT 189/4885CYP1A2 2374/4885

“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.