SCHEMBL14219616

SCHEMBL14219616

CONC(=O)c1cc(F)c(F)c(F)c1Nc1ncc(Cl)cc1C

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PTGS2 P35354 1/20 0.38
MAP2K1 Q02750 4/20 0.35
CHRNA7 P36544 3/20 0.34
KDR P35968 2/20 0.34
POLB P06746 1/20 0.34
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
CSF1R P07333 2/20 0.32
PIK3CA P42336 1/20 0.32
MTOR P42345 1/20 0.32
NUDT1 P36639 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
SCHEMBL14219627 0.89 MAP2K1 (0.43) DHODHKMT2APTGS2MAP2K1CHRNA7
SCHEMBL14223201 0.89 MEN1 (0.40) DHODHKMT2AMEN1TDP1PTGS2
SCHEMBL14219742 0.88 MEN1 (0.43) DHODHKMT2AMEN1TDP1MAP2K1
SCHEMBL14219715 0.88 PTGS2 (0.41) DHODHKMT2AMEN1TDP1PTGS2
SCHEMBL14223057 0.87 MAP2K1 (0.41) DHODHKMT2AMEN1TDP1MAP2K1
SCHEMBL14219648 0.87 MEN1 (0.39) DHODHKMT2AMEN1TDP1PTGS2
SCHEMBL14220160 0.86 MAP2K1 (0.49) KMT2AMEN1TDP1MAP2K1
SCHEMBL14219738 0.86 MEN1 (0.42) DHODHKMT2AMEN1TDP1MAP2K1
SCHEMBL14219743 0.86 MEN1 (0.42) DHODHKMT2AMEN1TDP1MAP2K1
SCHEMBL14219812 0.85 DHODH (0.51) DHODHMAP2K1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008041088-A2 N-HYDROXY BENZAMIDES WITH ANTITUMOR ACTIVITY EOS (ETHICAL ONCOLOGY SCIENCE) S.P.A. (IT) 2008-04-10 WO disclosed
EP-1908751-A1 N-hydroxy benzamides with antitumour activity EOS S.p.A. (IT) 2008-04-09 EP disclosed