SCHEMBL2398916

SCHEMBL2398916

[CH2]c1ccccc1C(F)(F)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.32

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
SCHEMBL3162553 0.87 P2RX7 (0.32) P2RX7
SCHEMBL7220209 0.77
SCHEMBL67468 0.74 ALDH1A1 (0.43)
SCHEMBL2089106 0.70 ALDH1A1 (0.31)
SCHEMBL5268073 0.70 ALDH1A1 (0.31)
SCHEMBL15401139 0.69 ALDH1A1 (0.39)
SCHEMBL395700 0.69 ALDH1A1 (0.50)
SCHEMBL817157 0.68 ALDH1A1 (0.30)
SCHEMBL12356881 0.67 ALDH1A1 (0.50)
SCHEMBL25078710 0.67 KIF11 (0.40) P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8252559-B2 Methods and systems for selective fluorination of organic molecules THE CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2012-08-28 US disclosed
US-8026085-B2 Methods and systems for selective fluorination of organic molecules CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2011-09-27 US disclosed
US-20090209010-A1 METHODS AND SYSTEMS FOR SELECTIVE FLUORINATION OF ORGANIC MOLECULES CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2009-08-20 US disclosed
US-20090061471-A1 Methods and systems for selective fluorination of organic molecules INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2009-03-05 US disclosed