SCHEMBL6583394

SCHEMBL6583394

FC(F)(F)CNc1cccc(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.50
GAA P10253 4/20 0.50
ALDH1A1 P00352 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
IDH2 P48735 3/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
XBP1 P17861 1/20 0.49
RAB9A P51151 2/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.47
RAPGEF4 Q8WZA2 1/20 0.47
IDO1 P14902 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KIF11 P52732 1/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
MMP2 P08253 1/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL30444332 0.85 IDH2 (0.54) MAPTGAAALDH1A1NPSR1TDP1
SCHEMBL11114461 0.82 MAPT (0.51) MAPTGAAALDH1A1NPSR1TDP1
SCHEMBL6582317 0.82 MAPT (0.45) MAPTGAAALDH1A1NPSR1TDP1
SCHEMBL16241281 0.81 KIF11 (0.51) MAPTGAAALDH1A1NPSR1TDP1
SCHEMBL30490047 0.81 LMNA (0.53) MAPTGAAALDH1A1NPSR1TDP1
SCHEMBL42000 0.81 LMNA (0.53) MAPTGAAALDH1A1NPSR1TDP1
SCHEMBL28009480 0.79 P2RX1 (0.44) MAPTALDH1A1RAPGEF4IDO1LMNA
SCHEMBL6232265 0.79 LMNA (0.63) MAPTGAAALDH1A1NPSR1TDP1
SCHEMBL8102983 0.79 MAPT (0.53) MAPTGAAALDH1A1NPSR1TDP1
SCHEMBL20714773 0.79 MAPT (0.49) MAPTGAAALDH1A1NPSR1TDP1

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
WO-2016183101-A1 PALLADIUM-CATALYZED ARYLATION OF FLUOROALKYLAMINES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-11-17 WO disclosed
CN-104642338-A Methods of pest control in soybean SYNGENTA PARTICIPATIONS AG 2015-05-27 CN disclosed
EP-0816359-B1 4-Amino-2-ureido-pyrimidine-5-carboxamides, processes for their preparation, medicaments containing these compounds, and their use AVENTIS PHARMA GMBH (DE) 2004-11-03 EP disclosed
US-5773447-A 4-AMINO-2-UREIDOPYRIMIDINE-5-CARBOXAMIDE FORMED BY AMIDATION HOECHST AKTIENGESELLSCHAFT (DE) 1998-06-30 US disclosed
EP-0816359-A1 4-Amino-2-ureido-pyrimidine-5-carboxamides, processes for their preparation, medicaments containing these compounds, and their use HOECHST AKTIENGESELLSCHAFT (DE) 1998-01-07 EP disclosed