SCHEMBL920985

SCHEMBL920985

Nc1ncccc1C(=O)NCc1cccc(Oc2ccc(I)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.53
HPGD P15428 2/20 0.52
KMT2A Q03164 2/20 0.52
ALDH1A1 P00352 2/20 0.49
KDM4E B2RXH2 1/20 0.49
USP2 O75604 1/20 0.49
MMP13 P45452 1/20 0.45
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45
MAPK14 Q16539 1/20 0.44
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44
TUBA4A P68366 1/20 0.44
TUBB4B P68371 1/20 0.44
TUBB3 Q13509 1/20 0.44
TUBB2A Q13885 1/20 0.44
TUBB8 Q3ZCM7 1/20 0.44

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
SCHEMBL921817 0.93 HPGD (0.53) MAPK8HPGDKMT2AALDH1A1KDM4E
SCHEMBL1680406 0.91 MAPK8 (0.63) MAPK8HPGDKMT2AALDH1A1KDM4E
SCHEMBL920221 0.90 MAPK8 (0.55) MAPK8HPGDKMT2AALDH1A1MMP13
SCHEMBL920462 0.89 MAPK8 (0.53) MAPK8HPGDKMT2AALDH1A1MMP13
SCHEMBL921549 0.89 MAPK8 (0.53) MAPK8HPGDKMT2AALDH1A1KDM4E
SCHEMBL920077 0.89 HPGD (0.62) MAPK8HPGDKMT2AALDH1A1KDM4E
SCHEMBL920049 0.89 MAPK8 (0.53) MAPK8HPGDKMT2AALDH1A1KDM4E
SCHEMBL921092 0.89 MMP13 (0.58) MAPK8HPGDKMT2AALDH1A1KDM4E
SCHEMBL920670 0.89 MAPK8 (0.53) MAPK8HPGDKMT2AALDH1A1KDM4E
SCHEMBL920562 0.88 HPGD (0.56) MAPK8HPGDKMT2AALDH1A1KDM4E

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 1273/4885KMT2A 2469/4885

“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.