SCHEMBL5775170

SCHEMBL5775170

Cn1c(C(F)(F)F)ccc(-c2cc(N)c(O)cc2Cl)c1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
COMT P21964 1/20 0.36
RAB9A P51151 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
GAA P10253 2/20 0.36
IDH1 O75874 1/20 0.35
LMNA P02545 3/20 0.34
NPC1 O15118 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HSD11B1 P28845 3/20 0.33
CYP2C9 P11712 1/20 0.33
DPP4 P27487 1/20 0.33
PLA2G1B P04054 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ATG4B Q9Y4P1 1/20 0.33
HPGD P15428 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
XBP1 P17861 2/20 0.32
LIPG Q9Y5X9 1/20 0.32
ALOX15 P16050 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
SCHEMBL5773816 0.81 BRD4 (0.39) COMTRAB9ASMN1; SMN2GAAIDH1
SCHEMBL5775116 0.74 HSD11B1 (0.47) RAB9ASMN1; SMN2GAAIDH1LMNA
SCHEMBL7678934 0.72 CECR2 (0.38) IDH1
SCHEMBL5775093 0.71 HSD11B1 (0.36) COMTRAB9ASMN1; SMN2GAAIDH1
SCHEMBL5776527 0.71 HSD11B1 (0.39) COMTRAB9ASMN1; SMN2GAAIDH1
SCHEMBL5775618 0.71 KMO (0.47) RAB9ASMN1; SMN2GAAIDH1LMNA
SCHEMBL17494888 0.70 RAB9A (0.44) RAB9ASMN1; SMN2GAAIDH1LMNA
SCHEMBL5776472 0.70 BRD4 (0.50) RAB9ASMN1; SMN2GAAIDH1LMNA
SCHEMBL5775231 0.70 RAB9A (0.37) COMTRAB9ASMN1; SMN2GAAIDH1
SCHEMBL5771977 0.69 MEN1 (0.37) RAB9ASMN1; SMN2GAALMNANPC1

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
EP-0885885-B1 PYRIDONE DERIVATIVES AND HERBICIDES KUMIAI CHEMICAL INDUSTRY CO (JP) 2006-01-04 EP disclosed
US-6472348-B1 Pyridone derivatives and herbicides KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2002-10-29 US disclosed
US-6265349-B1 Pyridone derivatives and herbicides KUMIAI CHEMICAL INDUSTRY CO., LTD (JP) 2001-07-24 US disclosed
US-6048823-A Pyridone derivatives and herbicides KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2000-04-11 US disclosed
EP-0885885-A1 PYRIDONE DERIVATIVES AND HERBICIDES KumaiI Chemical Industry Co., Ltd. (JP) 1998-12-23 EP disclosed