SCHEMBL9951972

SCHEMBL9951972

Fc1nc(F)c(F)c(C(F)(c2c(F)c(F)nc(F)c2F)C(F)(F)F)c1F

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 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
SCHEMBL1437045 0.77 MEN1 (0.39) MEN1MAPTHTTKMT2A
SCHEMBL14019031 0.69 MEN1 (0.32) MEN1MAPTHTTKMT2A
SCHEMBL7916528 0.67
SCHEMBL188694 0.64 MEN1 (0.41) MEN1MAPTHTTKMT2A
SCHEMBL6970069 0.62 MEN1 (0.32) MEN1MAPTHTTKMT2A
SCHEMBL443601 0.61 MEN1 (0.46) MEN1MAPTHTTKMT2A
SCHEMBL4832466 0.61
SCHEMBL12112190 0.60 MEN1 (0.31) MEN1MAPTHTTKMT2A
SCHEMBL8778784 0.59 MEN1 (0.30) MEN1MAPTHTTKMT2A
SCHEMBL4311227 0.58 MEN1 (0.33) MEN1MAPTHTTKMT2A

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
WO-2012087630-A1 PYRIDINE AND PYRIMIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-06-28 WO claimed
WO-2012087630-A1 PYRIDINE AND PYRIMIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-06-28 WO disclosed