SCHEMBL5314296

SCHEMBL5314296

COCN(C(=O)Nc1ccc(SC(F)(F)C(F)(F)C(F)(F)F)cc1F)C(=O)c1c(F)cccc1F

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
THRB P10828 1/20 0.35
KMT2A Q03164 1/20 0.35
HTT P42858 1/20 0.33
PPARG P37231 1/20 0.31
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31
BDKRB1 P46663 1/20 0.31
RORC P51449 1/20 0.30
RAB9A P51151 2/20 0.30
NPC1 O15118 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
POLB P06746 1/20 0.30
SCN9A Q15858 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
SCHEMBL5335591 0.94 HTT (0.34) ALDH1A1KMT2AHTTPPARGPPARD
SCHEMBL5316854 0.94 TLR7 (0.37) ALDH1A1LMNAKMT2ARAB9ASMN1; SMN2
SCHEMBL5316805 0.85 MEN1 (0.34) ALDH1A1KMT2AHTTPPARGPPARD
SCHEMBL5315021 0.85 HTT (0.37) ALDH1A1KMT2AHTTRAB9ANPC1
SCHEMBL5315879 0.85 HTT (0.34) KMT2AHTTRAB9ANPC1SMN1; SMN2
SCHEMBL5318469 0.82 SMN1; SMN2 (0.36) ALDH1A1LMNAKMT2AHTTRAB9A
SCHEMBL4149970 0.82 RXFP1 (0.35) HTTRAB9ANPC1SMN1; SMN2POLB
SCHEMBL5316114 0.82 KMT2A (0.35) ALDH1A1LMNAKMT2AHTT
SCHEMBL5316133 0.82 POLB (0.39) ALDH1A1LMNAKMT2ARAB9APOLB
SCHEMBL5314189 0.81 TLR7 (0.37) ALDH1A1LMNAKMT2ARORCRAB9A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007066496-A1 BENZOYLUREA COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-06-14 WO disclosed