SCHEMBL4101289

SCHEMBL4101289

Cc1nc(C(F)F)c(C(=O)Nc2ccsc2CC[Si](C)(C)C)s1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
NPC1 O15118 4/20 0.36
MAPT P10636 2/20 0.36
RECQL P46063 1/20 0.34
HPGD P15428 3/20 0.34
KMT2A Q03164 6/20 0.33
MEN1 O00255 3/20 0.33
TP53 P04637 2/20 0.32
TSHR P16473 1/20 0.32
KDM4E B2RXH2 1/20 0.32
CASP3 P42574 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
USP2 O75604 1/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GAA P10253 3/20 0.32
ALDH1A1 P00352 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
SCHEMBL3106873 0.87 MAPT (0.37) RAB9ASMN1; SMN2NPC1MAPTRECQL
SCHEMBL3117697 0.86 RAB9A (0.35) RAB9ASMN1; SMN2NPC1MAPTRECQL
SCHEMBL15132717 0.85 RAB9A (0.49) RAB9ASMN1; SMN2NPC1MAPTRECQL
SCHEMBL12798725 0.77 ATM (0.38)
SCHEMBL3109031 0.77 RAB9A (0.36) RAB9ASMN1; SMN2NPC1MAPTRECQL
SCHEMBL3121441 0.75 RAB9A (0.35) RAB9ASMN1; SMN2NPC1MAPTRECQL
SCHEMBL5577995 0.75 ABCC1 (0.37) RAB9ASMN1; SMN2NPC1MAPTHPGD
SCHEMBL14253653 0.73 RAB9A (0.48) RAB9ASMN1; SMN2NPC1MAPTRECQL
SCHEMBL12903702 0.73 HTT (0.51) RAB9ASMN1; SMN2NPC1MAPTRECQL
SCHEMBL2911307 0.72 RAB9A (0.46) RAB9ASMN1; SMN2NPC1RECQLHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101212899-B Carboxamides BAYER CROPSCIENCE AG 2012-11-21 CN claimed
US-20090105311-A1 Carboxamides BAYER CROPSCIENCE AG (DE) 2009-04-23 US claimed
EP-1890540-A2 CARBOXAMIDES Bayer CropScience AG (DE) 2008-02-27 EP claimed
WO-2006131221-A2 CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2006-12-14 WO claimed
US-20130190375-A1 CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2013-07-25 US disclosed
US-8431600-B2 Carboxamides BAYER CROPSCIENCE AG (DE) 2013-04-30 US disclosed
US-8431600-B2 Carboxamides BAYER CROPSCIENCE AG (DE) 2013-04-30 US disclosed
US-8431600-B2 Carboxamides BAYER CROPSCIENCE AG (DE) 2013-04-30 US disclosed
CN-101212899-B Carboxamides BAYER CROPSCIENCE AG 2012-11-21 CN disclosed
US-7897780-B2 Method for controlling phytopathogenic fungi using silylated carboxamides BAYER CROPSCIENCE AG (DE) 2011-03-01 US disclosed
US-20090105311-A1 Carboxamides BAYER CROPSCIENCE AG (DE) 2009-04-23 US disclosed
US-20090105311-A1 Carboxamides BAYER CROPSCIENCE AG (DE) 2009-04-23 US disclosed
EP-1890540-A2 CARBOXAMIDES Bayer CropScience AG (DE) 2008-02-27 EP disclosed
US-20070293455-A1 Silylated Carboxamides BAYER CROPSCIENCE AG (DE) 2007-12-20 US disclosed
WO-2006131221-A2 CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2006-12-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070293455-A1 Silylated Carboxamides MRPL21, MRPS22, MRM1 RAB9A 2076/4885SMN1; SMN2 1838/4885NPC1 3441/4885
US-20090105311-A1 Carboxamides NAAA, CBR3, CNR1 RAB9A 2505/4885SMN1; SMN2 2586/4885NPC1 3367/4885
US-20130190375-A1 CARBOXAMIDES NAAA, CBR3, CNR1 RAB9A 2505/4885SMN1; SMN2 2586/4885NPC1 3367/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.