SCHEMBL5774874

SCHEMBL5774874

Cn1c(C(F)(F)F)ccc(-c2cc(C(=O)O)c(Cl)cc2F)c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
GAA P10253 2/20 0.37
NOTUM Q6P988 3/20 0.35
NPC1 O15118 2/20 0.35
LMNA P02545 2/20 0.35
PDK2 Q15119 1/20 0.35
ALDH1A1 P00352 2/20 0.35
XDH P47989 1/20 0.35
SLC22A12 Q96S37 1/20 0.35
TP53 P04637 1/20 0.35
APP P05067 1/20 0.34
AKR1C3 P42330 1/20 0.34
AKR1C2 P52895 1/20 0.34
HSD11B1 P28845 1/20 0.34
PRKAB2 O43741 1/20 0.33
PRKAG1 P54619 1/20 0.33
PRKAA2 P54646 1/20 0.33
PRKAA1 Q13131 1/20 0.33
PRKAG3 Q9UGI9 1/20 0.33

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
SCHEMBL5775231 0.90 RAB9A (0.37) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL5775181 0.85 HPGD (0.35) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL5771579 0.84 PDK2 (0.34) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL5776527 0.82 HSD11B1 (0.39) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL5775093 0.82 HSD11B1 (0.36) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL5773816 0.81 BRD4 (0.39) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL5775225 0.80 RAB9A (0.35) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL5771984 0.79 HSD11B1 (0.34) RAB9ASMN1; SMN2GAANOTUMNPC1
SCHEMBL5776373 0.79 HSD11B1 (0.34) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL5775958 0.78 IDH1 (0.34) RAB9ASMN1; SMN2GAANPC1ALDH1A1

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