SCHEMBL3813790

SCHEMBL3813790

O=CCc1ccc(NCc2ccc(C(F)(F)F)cc2)nc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 2/20 0.52
KIT P10721 1/20 0.52
HDAC1 Q13547 2/20 0.51
HDAC6 Q9UBN7 2/20 0.51
HDAC3 O15379 1/20 0.51
HDAC2 Q92769 1/20 0.51
VNN1 O95497 3/20 0.48
EPHX2 P34913 1/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ASPH Q12797 2/20 0.44
KDM8 Q8N371 2/20 0.44
KDM4E B2RXH2 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
SCHEMBL1267411 0.86 CSF1R (0.49) CSF1RKITHDAC1HDAC6HDAC3
SCHEMBL1267867 0.80 HDAC3 (0.57) CSF1RKITHDAC1HDAC6HDAC3
SCHEMBL1266913 0.79 NPC1 (0.58) CSF1RKITHDAC1HDAC6HDAC3
SCHEMBL27787161 0.79 CSF1R (0.47) CSF1RKITHDAC1HDAC6HDAC3
SCHEMBL23260548 0.79 LSS (0.51) CSF1RKITHDAC1HDAC6HDAC3
SCHEMBL28780861 0.78 NPC1 (0.57) CSF1RKITHDAC1HDAC6HDAC3
SCHEMBL17113026 0.77 KDM4E (0.54) CSF1RKITHDAC1HDAC6HDAC3
SCHEMBL23261493 0.77 CSF1R (0.49) CSF1RKITHDAC1HDAC6HDAC3
SCHEMBL11936125 0.77 PTGS1 (0.56) CSF1RKITHDAC1HDAC6HDAC3
SCHEMBL20642067 0.76 FFAR1 (0.52) CSF1RKITHDAC1HDAC6HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2086972-A2 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON, INC. (US) 2009-08-12 EP disclosed
WO-2008063888-A2 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON, INC. (US) 2008-05-29 WO disclosed
WO-2008064255-A2 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON, INC. (US) 2008-05-29 WO disclosed