SCHEMBL7846580

SCHEMBL7846580

C[Si](C)(C)c1cccc(Cl)c1C(=O)NCCCCl

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
HPGD P15428 4/20 0.44
ALDH1A1 P00352 2/20 0.43
JAK2 O60674 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
PTGS2 P35354 1/20 0.42
P2RX7 Q99572 1/20 0.41
HDAC1 Q13547 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
TSHR P16473 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL7846596 0.91 HPGD (0.45) POLBHPGDALDH1A1JAK2SMN1; SMN2
SCHEMBL7854326 0.90 HPGD (0.57) HPGDALDH1A1SMN1; SMN2L3MBTL1TSHR
SCHEMBL7856886 0.88 HPGD (0.51) HPGDALDH1A1SMN1; SMN2PTGS2HDAC1
SCHEMBL7846577 0.87 SMN1; SMN2 (0.54) POLBHPGDALDH1A1SMN1; SMN2P2RX7
SCHEMBL7845245 0.87 POLB (0.46) POLBHPGDALDH1A1SMN1; SMN2P2RX7
SCHEMBL7853566 0.86 SMN1; SMN2 (0.44) POLBHPGDALDH1A1SMN1; SMN2P2RX7
SCHEMBL7856328 0.86 HPGD (0.43) POLBHPGDALDH1A1SMN1; SMN2PTGS2
SCHEMBL7853870 0.84 HPGD (0.51) HPGDALDH1A1TSHR
SCHEMBL7224446 0.84 HPGD (0.46) POLBHPGDALDH1A1JAK2SMN1; SMN2
SCHEMBL7219457 0.81 HPGD (0.44) POLBHPGDALDH1A1SMN1; SMN2TSHR

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-1088481-A2 Fungicides for the control of take-all disease of plants MONSANTO COMPANY (US) 2001-04-04 EP disclosed