SCHEMBL7843281

SCHEMBL7843281

COc1ccccc1-c1c[nH]c(CCCCCNC(=O)OCc2ccccc2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.47
TGM2 P21980 1/20 0.46
BRD4 O60885 2/20 0.44
KEAP1 Q14145 3/20 0.43
NFE2L2 Q16236 3/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TPSAB1 Q15661 2/20 0.42
TPSD1 Q9BZJ3 2/20 0.42
TPSG1 Q9NRR2 2/20 0.42
ASAH1 Q13510 1/20 0.42
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
FOLH1 Q04609 2/20 0.41
IDO1 P14902 1/20 0.41
PLG P00747 1/20 0.41
ELANE P08246 1/20 0.41
BRD2 P25440 1/20 0.40
BRD3 Q15059 1/20 0.40

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
SCHEMBL2788524 0.86 LMNA (0.44) HTTBRD4MEN1KMT2AL3MBTL1
SCHEMBL8320312 0.85 TGM2 (0.52) HTTTGM2KEAP1NFE2L2LMNA
SCHEMBL14736555 0.78 CDK4 (0.44) LMNASMN1; SMN2
SCHEMBL7843917 0.77 BRD4 (0.41) HTTTGM2BRD4KEAP1NFE2L2
SCHEMBL14736076 0.76 IDO1 (0.55) IDO1
SCHEMBL1928930 0.74 IDO1 (0.49) HTTTGM2KEAP1NFE2L2L3MBTL1
SCHEMBL8657051 0.73 HSP90AA1 (0.41) KMT2AL3MBTL1
SCHEMBL6129197 0.73 MGLL (0.47)
SCHEMBL1927752 0.73 KDM4E (0.46)
SCHEMBL9874334 0.73 HTT (0.79) HTTTGM2KEAP1NFE2L2L3MBTL1

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-1140942-A2 PRENYL TRANSFERASE INHIBITORS SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2001-10-10 EP disclosed
WO-2000039130-A2 PRENYL TRANSFERASE INHIBITORS SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES S.A.S. (FR) 2000-07-06 WO disclosed