SCHEMBL1505084

SCHEMBL1505084

CCC(O)C(C)C(Br)C(O)CC(C)/C=C/C=C(\C)C1OC(=O)CC(O)CC(O)C(C)C(OC(C)=O)/C=C/C1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SF3B3 Q15393 8/20 0.44
HMGCR P04035 2/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
LMNA P02545 2/20 0.31
CYP3A4 P08684 2/20 0.31
TSHR P16473 2/20 0.31
ABCB11 O95342 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
MTOR P42345 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
GMNN O75496 1/20 0.31
TP53 P04637 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
NFKB1 P19838 1/20 0.31
BLM P54132 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
SCHEMBL1504984 0.89 SF3B3 (0.43) SF3B3HMGCRMEN1KMT2ASMN1; SMN2
SCHEMBL3625445 0.83 SF3B3 (0.61) SF3B3HMGCRMEN1KMT2ASMN1; SMN2
SCHEMBL3556019 0.83 SF3B3 (0.56) SF3B3HMGCR
SCHEMBL13503202 0.77 SF3B3 (0.51) SF3B3HMGCRMEN1KMT2ASMN1; SMN2
SCHEMBL13503194 0.76 SF3B3 (0.57) SF3B3HMGCRMEN1KMT2ASMN1; SMN2
SCHEMBL14423036 0.76 SF3B3 (0.50) SF3B3HMGCRMEN1KMT2ASMN1; SMN2
SCHEMBL1504986 0.76 SF3B3 (0.55) SF3B3HMGCR
SCHEMBL1504770 0.75 SF3B3 (0.51) SF3B3
SCHEMBL13503199 0.75 SF3B3 (0.58) SF3B3HMGCRMEN1KMT2ASMN1; SMN2
SCHEMBL3626035 0.75 SF3B3 (0.65) SF3B3HMGCRMEN1KMT2ASMN1; SMN2

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
EP-2292610-A1 Macrolides with VEGF transcription suppression activity MERCIAN CORPORATION (JP) 2011-03-09 EP disclosed