SCHEMBL6809652

SCHEMBL6809652

CCOC(=O)C(C(=O)O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.48
NPSR1 Q6W5P4 1/20 0.46
POLB P06746 1/20 0.45
FFAR1 O14842 5/20 0.44
PPARG P37231 3/20 0.44
KMT2A Q03164 3/20 0.44
EPHX2 P34913 1/20 0.44
PPARA Q07869 1/20 0.43
AKR1C3 P42330 2/20 0.42
AKR1C2 P52895 2/20 0.42
PSEN1 P49768 1/20 0.42
PSEN2 P49810 1/20 0.42
APH1B Q8WW43 1/20 0.42
NCSTN Q92542 1/20 0.42
APH1A Q96BI3 1/20 0.42
PSENEN Q9NZ42 1/20 0.42
MEN1 O00255 2/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
MAPT P10636 2/20 0.41

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
SCHEMBL1043699 0.92 NPSR1 (0.49) MMP8NPSR1POLBFFAR1PPARG
SCHEMBL4748728 0.88 NPSR1 (0.46) MMP8NPSR1POLBFFAR1PPARG
SCHEMBL7934481 0.87 AKR1C3 (0.47) KMT2AEPHX2AKR1C3AKR1C2CES2
SCHEMBL28147664 0.82 NPSR1 (0.49) NPSR1POLBFFAR1PPARGKMT2A
SCHEMBL7090567 0.81 MMP8 (0.52) MMP8NPSR1PPARGKMT2AEPHX2
SCHEMBL9047892 0.81 SRC (0.54) FFAR1EPHX2AKR1C3AKR1C2PSEN1
SCHEMBL9315410 0.81 POLB (0.50) NPSR1POLBFFAR1PPARGKMT2A
SCHEMBL6675458 0.81 CES2 (0.56) NPSR1POLBFFAR1PPARGKMT2A
SCHEMBL2484700 0.81 CES2 (0.56) NPSR1POLBFFAR1PPARGKMT2A
SCHEMBL1275691 0.80 MMP8 (0.70) MMP8POLBKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040209202-A1 Fluorinated oxyvinyl compounds HONEYWELL INTERNATIONAL INC. 2004-10-21 US disclosed
US-6743943-B2 USEFUL IN MAKING PROTECTIVE COATINGS, RELEASE COATINGS, SURFACTANTS, ANTICORROSION AGENTS, AND ANTIOXIDIZING AGENTS FOR FIBER OPTICS, WAVEGUIDES; PHOTOCURING HONEYWELL INTERNATIONAL INC. 2004-06-01 US disclosed
US-20010034458-A1 Polymerizable halogenated vinyl ethers ALLIEDSIGNAL INC. 2001-10-25 US disclosed
EP-1140759-A1 POLYMERIZABLE HALOGENATED VINYL ETHERS AlliedSignal Inc. (US) 2001-10-10 EP disclosed
WO-2000037403-A1 POLYMERIZABLE HALOGENATED VINYL ETHERS ALLIEDSIGNAL INC. (US) 2000-06-29 WO 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-20010034458-A1 Polymerizable halogenated vinyl ethers NCEH1, ECH1, CFH MMP8 3287/4885NPSR1 3714/4885POLB 2138/4885

“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.