SCHEMBL1809010

SCHEMBL1809010

C[Si](C)(C)CNC(=O)c1ccc(C=NO)c(C(F)(F)F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
PKM P14618 2/20 0.38
MAPT P10636 1/20 0.38
ATM Q13315 1/20 0.38
EPHX2 P34913 2/20 0.37
ADCY8 P40145 2/20 0.36
ADCY1 Q08828 2/20 0.36
HDAC3 O15379 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
ABL1 P00519 1/20 0.36
BCR P11274 1/20 0.36
SRC P12931 1/20 0.36
MAPK14 Q16539 1/20 0.36
DRD4 P21917 1/20 0.36
DDR1 Q08345 1/20 0.35
ALDH1A1 P00352 2/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL1809009 1.00 NPC1 (0.40) NPC1RAB9APKMMAPTATM
SCHEMBL1806743 0.86 EPHX2 (0.39) PKMMAPTEPHX2ADCY8ADCY1
SCHEMBL1807398 0.74 AR (0.50)
SCHEMBL1806730 0.74 DDR1 (0.41) NPC1RAB9AMAPTEPHX2ADCY8
SCHEMBL15492067 0.70 HPGD (0.49) NPC1RAB9APKMALDH1A1POLB
SCHEMBL28553348 0.67 LMNA (0.58) MAPTHDAC3HTT
SCHEMBL5307396 0.67 ALDH1A1 (0.40) NPC1RAB9APKMMAPTATM
SCHEMBL30292169 0.67 ALDH1A1 (0.40) NPC1RAB9APKMMAPTATM
SCHEMBL4880854 0.67 CES2 (0.46) PKMMAPTEPHX2ALDH1A1KDM4E
SCHEMBL5307395 0.67 ALDH1A1 (0.40) NPC1RAB9APKMMAPTATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2563779-A1 INSECTICIDAL ARYLPYRROLINE COMPOUNDS Bayer CropScience AG (DE) 2013-03-06 EP disclosed
US-8158560-B2 Insecticidal arylpyrroline compounds BAYER CROPSCIENCE AG (DE) 2012-04-17 US disclosed
US-20110118319-A1 Insecticidal Arylpyrroline Compounds BAYER CROPSCIENCE AG (DE) 2011-05-19 US disclosed
WO-2011054871-A1 INSECTICIDAL ARYLPYRROLINE COMPOUNDS BAYER CROPSCIENCE AG (DE) 2011-05-12 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 (1 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-20110118319-A1 Insecticidal Arylpyrroline Compounds DDT, LAP3, CYP4X1 NPC1 4027/4885RAB9A 797/4885PKM 2397/4885

“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.