SCHEMBL28200009

SCHEMBL28200009

NC(=O)C1=CN(CC(F)(F)F)C=CC1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.35
CCNA2 P20248 2/20 0.32
CDK2 P24941 2/20 0.32
CCNA1 P78396 2/20 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
Hydrochloric Acid SCHEMBL28200003 0.98 LDHA (0.34) LDHACCNA2CDK2CCNA1
SCHEMBL677632 0.78 LDHA (0.37) LDHA
Caricotamide SCHEMBL6546956 0.78 LDHA (0.37) LDHA
SCHEMBL444311 0.75 LDHA (0.36) LDHA
SCHEMBL29217620 0.75 LDHA (0.34) LDHA
SCHEMBL28639430 0.73 CNR2 (0.36) LDHA
SCHEMBL2205423 0.72 ADRA1D (0.41)
SCHEMBL9334115 0.70 LDHA (0.33) LDHA
SCHEMBL23010949 0.69 LDHA (0.34) LDHA
SCHEMBL1274356 0.68 LDHA (0.36) LDHA

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
CN-104185627-B Pyridone Derivatives 第三共株式会社 2018-01-12 CN claimed
CN-104185627-B Pyridone Derivatives 第三共株式会社 2018-01-12 CN disclosed