SCHEMBL5030822

SCHEMBL5030822

Cn1c(C(F)(F)F)ccc(C=O)c1=O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
GAA P10253 2/20 0.42
NPC1 O15118 2/20 0.40
LMNA P02545 2/20 0.40
HPGD P15428 1/20 0.37
ALDH1A1 P00352 3/20 0.36
IDH1 O75874 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 2/20 0.33
PABPC1 P11940 1/20 0.33
HTT P42858 1/20 0.33
GFER P55789 1/20 0.33
HKDC1 Q2TB90 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
IMPDH2 P12268 1/20 0.30

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
SCHEMBL9911990 0.75 RAB9A (0.49) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL17494888 0.73 RAB9A (0.44) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL21479586 0.72 RAB9A (0.40) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL17494864 0.70 RAB9A (0.56) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL3051505 0.69 RAB9A (0.48) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL3052229 0.68 RAB9A (0.47) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL3056330 0.68 LMNA (0.54) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL3045673 0.66 RAB9A (0.51) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL5771668 0.65 RAB9A (0.38) RAB9ASMN1; SMN2GAANPC1LMNA
SCHEMBL13680580 0.65 RAB9A (0.39) RAB9ASMN1; SMN2GAANPC1LMNA

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
EP-1982978-B1 PYRIDONE DERIVATIVE AND HERBICIDE KUMIAI CHEMICAL INDUSTRY CO (JP) 2014-08-27 EP disclosed
EP-1982978-A1 PYRIDONE DERIVATIVE AND HERBICIDE KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2008-10-22 EP disclosed