SCHEMBL8094904

SCHEMBL8094904

Cc1sc([Si](C)(C)C)c(C(=O)O)c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.44
RECQL P46063 1/20 0.44
ABCC1 P33527 3/20 0.38
ALDH1A1 P00352 6/20 0.37
MAPT P10636 6/20 0.37
LMNA P02545 2/20 0.37
GRIN2C Q14957 1/20 0.36
ALOX12 P18054 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HPGD P15428 2/20 0.34
TSHR P16473 2/20 0.34
PDE10A Q9Y233 2/20 0.34
PLA2G1B P04054 1/20 0.33
MAPK1 P28482 1/20 0.33
ATG4B Q9Y4P1 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32

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
SCHEMBL16993653 0.82 AIP (0.44) POLBALDH1A1MAPTLMNAGRIN2C
SCHEMBL8304526 0.75 POLB (0.52) POLBRECQLABCC1ALDH1A1MAPT
SCHEMBL7217363 0.74 TSHR (0.41) ABCC1ALDH1A1MAPTNPC1HPGD
SCHEMBL3228565 0.70 POLB (0.47) POLBRECQLABCC1ALDH1A1MAPT
SCHEMBL3497284 0.70 ALDH1A1 (0.61) POLBRECQLABCC1ALDH1A1MAPT
SCHEMBL5080674 0.66 DAO (0.42) POLBRECQLABCC1ALDH1A1MAPT
SCHEMBL8330157 0.64 PRNP (0.45) ABCC1ALDH1A1LMNAL3MBTL1RAB9A
SCHEMBL21612947 0.64 ALDH1A1 (0.61) POLBABCC1ALDH1A1MAPTLMNA
SCHEMBL8306201 0.64 L3MBTL1 (0.42) POLBRECQLABCC1ALDH1A1MAPT
SCHEMBL13398540 0.63 GRM6 (0.49) POLBRECQLALDH1A1MAPTLMNA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0797578-B1 FUNGICIDES FOR THE CONTROL OF TAKE-ALL DISEASE OF PLANTS MONSANTO CO (US) 2000-05-10 EP disclosed
CN-1052234-C Fungicides for the control of take-all disease of plants MONSANTO CO (US) 2000-05-10 CN disclosed
CN-1176642-A Fungicide for preventing and treating take-all disease of plant MONSANTO CO (US) 1998-03-18 CN disclosed
EP-0797578-A1 FUNGICIDES FOR THE CONTROL OF TAKE-ALL DISEASE OF PLANTS MONSANTO COMPANY (US) 1997-10-01 EP disclosed
WO-1996018631-A1 FUNGICIDES FOR THE CONTROL OF TAKE-ALL DISEASE OF PLANTS MONSANTO COMPANY (US) 1996-06-20 WO disclosed
US-5486621-A 4,5-DOMETHYL-N-2-PROPENYL-2-(TRIMETHYLSILYL)-3-THIOPHENE CARBOXAMIDE MONSANTO COMPANY (US) 1996-01-23 US disclosed