SCHEMBL921380

SCHEMBL921380

Nc1ncccc1C(=O)NCc1cccc(Oc2ccccc2I)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.51
HPGD P15428 3/20 0.50
ALDH1A1 P00352 3/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 2/20 0.50
USP2 O75604 1/20 0.50
MAPT P10636 2/20 0.48
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.48
NSD2 O96028 1/20 0.45
RAB9A P51151 1/20 0.43
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 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
SCHEMBL921672 0.89 MAPK8 (0.54) MAPK8HPGDALDH1A1KMT2AKDM4E
SCHEMBL919917 0.88 MAPK8 (0.51) MAPK8HPGDALDH1A1KMT2AKDM4E
SCHEMBL27824564 0.88 MAPK8 (0.51) MAPK8HPGDALDH1A1KMT2AKDM4E
SCHEMBL921405 0.88 HPGD (0.53) MAPK8HPGDALDH1A1KMT2AKDM4E
SCHEMBL919900 0.88 HPGD (0.58) MAPK8HPGDALDH1A1KMT2AKDM4E
SCHEMBL919713 0.88 MAPK8 (0.51) MAPK8HPGDALDH1A1KMT2AKDM4E
SCHEMBL920572 0.88 MAPK8 (0.51) MAPK8HPGDALDH1A1KMT2AKDM4E
SCHEMBL1680406 0.87 MAPK8 (0.63) MAPK8HPGDALDH1A1KMT2AKDM4E
SCHEMBL920944 0.87 HPGD (0.54) MAPK8HPGDALDH1A1KMT2AKDM4E
SCHEMBL919731 0.87 HPGD (0.59) MAPK8HPGDALDH1A1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
EP-2248423-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP 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-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 MAPK8 2313/4885HPGD 1273/4885ALDH1A1 2743/4885

“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.