SCHEMBL7846596

SCHEMBL7846596

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

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.45
ALDH1A1 P00352 2/20 0.45
POLB P06746 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
P2RX7 Q99572 2/20 0.43
RAB9A P51151 1/20 0.40
TSHR P16473 1/20 0.40
GLA P06280 1/20 0.40
PKM P14618 1/20 0.40
ALDH2 P05091 1/20 0.39
NPC1 O15118 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
JAK2 O60674 1/20 0.39
CYP3A4 P08684 1/20 0.39
JAK1 P23458 1/20 0.39
TYK2 P29597 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
SCHEMBL7846580 0.91 POLB (0.45) HPGDALDH1A1POLBSMN1; SMN2P2RX7
SCHEMBL7846577 0.90 SMN1; SMN2 (0.54) HPGDALDH1A1POLBSMN1; SMN2P2RX7
SCHEMBL7845245 0.90 POLB (0.46) HPGDALDH1A1POLBSMN1; SMN2P2RX7
SCHEMBL7856328 0.88 HPGD (0.43) HPGDALDH1A1POLBSMN1; SMN2P2RX7
SCHEMBL7853566 0.88 SMN1; SMN2 (0.44) HPGDALDH1A1POLBSMN1; SMN2P2RX7
SCHEMBL7854326 0.87 HPGD (0.57) HPGDALDH1A1SMN1; SMN2TSHR
SCHEMBL7853870 0.87 HPGD (0.51) HPGDALDH1A1TSHRGLAPKM
SCHEMBL7224446 0.86 HPGD (0.46) HPGDALDH1A1POLBSMN1; SMN2P2RX7
SCHEMBL9721581 0.85 ALDH1A1 (0.59) HPGDALDH1A1POLBSMN1; SMN2P2RX7
SCHEMBL7856886 0.85 HPGD (0.51) HPGDALDH1A1SMN1; 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