SCHEMBL6174486

SCHEMBL6174486

COc1cc(C(C)C2NC(=O)N(c3ccc(S(=O)(=O)C(F)(F)F)cc3)C2=O)ccn1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 2/20 0.38
LMNA P02545 2/20 0.35
LARS1 Q9P2J5 1/20 0.34
MAT2A P31153 1/20 0.33
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
GRM2 Q14416 2/20 0.32
HRH4 Q9H3N8 2/20 0.32
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TRPV3 Q8NET8 2/20 0.31
GABRA1 P14867 1/20 0.30
GABRG2 P18507 1/20 0.30
GABRB3 P28472 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
SCHEMBL6172236 0.91 IGF1R (0.39) IGF1RLMNALARS1HRH4MAPK1
SCHEMBL6177896 0.88 LMNA (0.48) IGF1RLMNA
SCHEMBL6173182 0.87 IGF1R (0.40) IGF1RLMNALARS1HRH4SMN1; SMN2
SCHEMBL6173577 0.87 IGF1R (0.39) IGF1RLMNALARS1HRH4MAPK1
SCHEMBL6175008 0.87 IGF1R (0.39) IGF1RLMNALARS1HRH4MAPK1
SCHEMBL6173224 0.86 LMNA (0.36) IGF1RLMNAMAT2ASMN1; SMN2
SCHEMBL6175142 0.84 IGF1R (0.38) IGF1RLMNALARS1NR1H2NR1H3
SCHEMBL6173932 0.84 IGF1R (0.40) IGF1RLMNASMN1; SMN2
SCHEMBL6173894 0.83 IGF1R (0.37) IGF1RLMNALARS1HRH4MAPK1
SCHEMBL6177752 0.83 IGF1R (0.37) IGF1RLMNATRPV3

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-1599464-A2 NOVEL CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS Aventis Pharma S.A. (FR) 2005-11-30 EP disclosed
WO-2004070050-A2 CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS AVENTIS PHARMA S.A. (FR) 2004-08-19 WO disclosed