SCHEMBL5776527

SCHEMBL5776527

Cc1cc(-c2ccc(C(F)(F)F)n(C)c2=O)c(F)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 7/20 0.39
RAB9A P51151 3/20 0.37
GAA P10253 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
IDH1 O75874 1/20 0.34
NPC1 O15118 2/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
COMT P21964 1/20 0.33
ITGB1 P05556 2/20 0.32
ITGA4 P13612 2/20 0.32
ITGB7 P26010 2/20 0.32
HPGD P15428 1/20 0.31
EGFR P00533 1/20 0.31
PDGFRB P09619 1/20 0.31
FGFR1 P11362 1/20 0.31
SRC P12931 1/20 0.31
PDGFRA P16234 1/20 0.31
STAT5A P42229 1/20 0.31
ACVR1 Q04771 1/20 0.31

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
SCHEMBL5775093 0.86 HSD11B1 (0.36) HSD11B1RAB9AGAASMN1; SMN2IDH1
SCHEMBL5773816 0.85 BRD4 (0.39) HSD11B1RAB9AGAASMN1; SMN2IDH1
SCHEMBL5771984 0.83 HSD11B1 (0.34) HSD11B1RAB9AGAASMN1; SMN2IDH1
SCHEMBL5776373 0.83 HSD11B1 (0.34) HSD11B1RAB9AGAASMN1; SMN2IDH1
SCHEMBL5773573 0.82 IDH1 (0.36) HSD11B1RAB9AGAASMN1; SMN2IDH1
SCHEMBL5775958 0.82 IDH1 (0.34) HSD11B1RAB9AGAASMN1; SMN2IDH1
SCHEMBL5774291 0.82 RAB9A (0.34) HSD11B1RAB9AGAASMN1; SMN2IDH1
SCHEMBL5774874 0.82 RAB9A (0.37) HSD11B1RAB9AGAASMN1; SMN2NPC1
SCHEMBL5775231 0.82 RAB9A (0.37) HSD11B1RAB9AGAASMN1; SMN2IDH1
SCHEMBL5775121 0.82 HSD11B1 (0.34) HSD11B1RAB9AGAASMN1; SMN2IDH1

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