SCHEMBL10068147

SCHEMBL10068147

COc1ccc(OC(=O)Nc2cccc(C(C)(C)C)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HTT P42858 2/20 0.51
ALDH1A1 P00352 2/20 0.51
NPC1 O15118 5/20 0.49
RAB9A P51151 4/20 0.49
MAPT P10636 2/20 0.47
GBA1 P04062 1/20 0.47
TSHR P16473 1/20 0.47
KMT2A Q03164 5/20 0.44
ADORA3 P0DMS8 1/20 0.44
MEN1 O00255 3/20 0.43
PLK4 O00444 1/20 0.43
DYRK3 O43781 1/20 0.43
MAP4K4 O95819 1/20 0.43
CDK1 P06493 1/20 0.43
RET P07949 1/20 0.43
ROS1 P08922 1/20 0.43
FGFR1 P11362 1/20 0.43
FER P16591 1/20 0.43

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
SCHEMBL29739290 0.89 ALDH1A1 (0.47) GAASMN1; SMN2HTTALDH1A1RAB9A
SCHEMBL10068146 0.84 ADORA3 (0.63) SMN1; SMN2ALDH1A1NPC1RAB9AMAPT
SCHEMBL10220181 0.79 LCK (0.45) GAANPC1RAB9AKMT2AMEN1
SCHEMBL10068143 0.77 FPR2 (0.58) SMN1; SMN2HTTALDH1A1NPC1RAB9A
SCHEMBL10078879 0.76 RXFP1 (0.42) SMN1; SMN2NPC1RAB9AMAPTTSHR
SCHEMBL77635 0.76 KMT2A (0.70) GAASMN1; SMN2HTTALDH1A1NPC1
SCHEMBL1568515 0.75 TAS2R14 (0.52) ALDH1A1MAPTPLK4DYRK3MAP4K4
SCHEMBL10183380 0.75 KDM4E (0.57) SMN1; SMN2ALDH1A1RAB9AMAPTGBA1
SCHEMBL29177265 0.75 RAB9A (0.49) SMN1; SMN2NPC1RAB9AMAPTGBA1
SCHEMBL10068157 0.74 HPGD (0.47) SMN1; SMN2ALDH1A1NPC1RAB9AMAPT

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-8119646-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2012-02-21 US disclosed
US-8119646-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2012-02-21 US disclosed
US-20090258875-A1 Fungicide Hydroximoyl-Tetrazole Derivatives BAYER CROPSCIENCE AG (DE) 2009-10-15 US disclosed
US-20090258875-A1 Fungicide Hydroximoyl-Tetrazole Derivatives BAYER CROPSCIENCE AG (DE) 2009-10-15 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 (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-20090258875-A1 Fungicide Hydroximoyl-Tetrazole Derivatives HAAO, CYP51A1, CYP8B1 GAA 941/4885SMN1; SMN2 4458/4885HTT 148/4885

“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.