SCHEMBL3339491

SCHEMBL3339491

FC(F)(F)OCCCCCCCCCCCCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.50
CES1 P23141 3/20 0.50
SIGMAR1 Q99720 7/20 0.47
IDO1 P14902 1/20 0.47
MAOA P21397 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
NAAA Q02083 1/20 0.44
MAOB P27338 1/20 0.44

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
SCHEMBL13325994 1.00 FAAH (0.50) FAAHCES1SIGMAR1IDO1MAOA
SCHEMBL9668635 0.92 IDO1 (0.55) FAAHCES1SIGMAR1IDO1MAOA
SCHEMBL3092432 0.84 CA1 (0.44) FAAHCES1IDO1TDP1L3MBTL1
SCHEMBL3335357 0.81 L3MBTL1 (0.50) TDP1L3MBTL1NAAA
SCHEMBL816968 0.81 L3MBTL1 (0.50) TDP1L3MBTL1NAAA
SCHEMBL22282162 0.78 IDO1 (0.48) SIGMAR1IDO1MAOATDP1L3MBTL1
SCHEMBL11516805 0.77 SIGMAR1 (0.56) SIGMAR1IDO1MAOATDP1L3MBTL1
SCHEMBL7449055 0.77 TDP1 (0.61) SIGMAR1IDO1MAOATDP1L3MBTL1
SCHEMBL7449325 0.77 TDP1 (0.61) SIGMAR1IDO1MAOATDP1L3MBTL1
SCHEMBL7448881 0.77 TDP1 (0.61) SIGMAR1IDO1MAOATDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100152081-A1 Fluorosurfactants MERCK PATENT GMBH (DE) 2010-06-17 US disclosed
US-20100152081-A1 Fluorosurfactants MERCK PATENT GMBH (DE) 2010-06-17 US disclosed
US-20100152081-A1 Fluorosurfactants MERCK PATENT GMBH (DE) 2010-06-17 US disclosed
EP-2035131-A2 FLUOROSURFACTANTS Merck Patent GmbH (DE) 2009-03-18 EP disclosed
WO-2008003446-A2 FLUOROSURFACTANTS MERCK PATENT GMBH (DE) 2008-01-10 WO disclosed
WO-2008003446-A2 FLUOROSURFACTANTS MERCK PATENT GMBH (DE) 2008-01-10 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-20100152081-A1 Fluorosurfactants CBR3, FPR3, NOX3 FAAH 1225/4885CES1 1576/4885SIGMAR1 347/4885

“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.