SCHEMBL8007008

SCHEMBL8007008

Cc1c(F)c(F)c(F)c(F)c1C(=O)CC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 13/20 0.42
TAS1R1 Q7RTX1 12/20 0.42
TAS1R2 Q8TE23 12/20 0.42
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
PKM P14618 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
TSHR P16473 1/20 0.34
RECQL P46063 1/20 0.34
GAA P10253 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
SCHEMBL330842 0.84 HTT (0.43) HTTSMN1; SMN2PKMMEN1KMT2A
SCHEMBL8013023 0.77 CA1 (0.38) TAS1R3TAS1R1TAS1R2SMN1; SMN2MEN1
SCHEMBL8111865 0.77 GAA (0.48) TAS1R3TAS1R1TAS1R2HTTSMN1; SMN2
SCHEMBL2011531 0.77 MEN1 (0.46) TAS1R3TAS1R1TAS1R2SMN1; SMN2PKM
SCHEMBL9135192 0.75 HTT (0.36) HTTSMN1; SMN2PKMMEN1KMT2A
SCHEMBL9378716 0.75 HTT (0.33) HTTSMN1; SMN2PKMTSHRRECQL
SCHEMBL10440650 0.74 ALDH1A1 (0.35) SMN1; SMN2MEN1KMT2A
SCHEMBL8437290 0.72 ALDH1A1 (0.35) TAS1R3TAS1R1TAS1R2SMN1; SMN2
SCHEMBL7024101 0.71 HTT (0.48) TAS1R3TAS1R1TAS1R2HTTSMN1; SMN2
SCHEMBL12695380 0.71 HTT (0.61) TAS1R3TAS1R1TAS1R2HTTSMN1; SMN2

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-0593766-B1 PYRIDONECARBOXYLIC ACID DERIVATIVE DAIICHI SEIYAKU CO (JP) 2000-09-06 EP disclosed
US-5696132-A MICROBIOCIDES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-12-09 US disclosed
EP-0593766-A1 PYRIDONECARBOXYLIC ACID DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1994-04-27 EP disclosed