SCHEMBL92487

SCHEMBL92487

CCc1csc(NC(=O)Cc2ccccc2)n1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELOVL1 Q9BW60 1/20 0.65
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
PRKACA P17612 1/20 0.61
ROCK1 Q13464 1/20 0.61
LMNA P02545 1/20 0.60
TP53 P04637 1/20 0.60
GLS O94925 1/20 0.58
CCNE1 P24864 1/20 0.56
CDK2 P24941 1/20 0.56
CDK5 Q00535 1/20 0.56
ITGB1 P05556 1/20 0.56
ITGA4 P13612 1/20 0.56
RORC P51449 1/20 0.56
GAA P10253 1/20 0.55
APP P05067 1/20 0.55
HSD17B10 Q99714 1/20 0.55
SLC12A2 P55011 1/20 0.54
SLC12A5 Q9H2X9 1/20 0.54
PDE5A O76074 1/20 0.54

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
SCHEMBL10084284 0.86 MEN1 (0.67) MEN1KMT2ATP53HSD17B10PDE5A
SCHEMBL9834404 0.86 ELOVL1 (0.65) ELOVL1MEN1KMT2APRKACAROCK1
SCHEMBL10082482 0.84 PDE5A (0.68) MEN1KMT2APDE5APDE1APDE1B
SCHEMBL10084292 0.83 CSNK1D (0.57) ELOVL1MEN1KMT2AGAAHSD17B10
SCHEMBL28268613 0.83 RAB9A (0.75) ELOVL1MEN1KMT2APRKACAROCK1
SCHEMBL91397 0.81 ROCK2 (0.62) MEN1KMT2AROCK1LMNATP53
SCHEMBL10084516 0.80 SMN1; SMN2 (0.62) MEN1KMT2ALMNATP53HSD17B10
SCHEMBL91391 0.80 KDM4E (0.69) MEN1KMT2ACDK5HSD17B10PDE5A
SCHEMBL77834 0.80 KMT2A (0.77) ELOVL1MEN1KMT2APRKACAROCK1
SCHEMBL10084285 0.80 ELOVL1 (0.64) ELOVL1MEN1KMT2APRKACAROCK1

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
US-8129415-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2012-03-06 US disclosed
US-8119645-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2012-02-21 US disclosed
US-20090291969-A1 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2009-11-26 US disclosed
US-20090192196-A1 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2009-07-30 US 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 (2 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-20090192196-A1 Fungicide hydroximoyl-tetrazole derivatives HAAO, HAO1, CYP51A1 ELOVL1 3631/4885MEN1 930/4885KMT2A 609/4885
US-20090291969-A1 Fungicide hydroximoyl-tetrazole derivatives HAAO, HAO1, CYP51A1 ELOVL1 3631/4885MEN1 938/4885KMT2A 663/4885

“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.