SCHEMBL3132900

SCHEMBL3132900

COc1ccc(C(=O)NCC2CCCCC2)cc1OC

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.74
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
PDE4A P27815 3/20 0.59
PDE4B Q07343 3/20 0.59
PDE4C Q08493 3/20 0.59
PDE4D Q08499 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.58
MAPK14 Q16539 1/20 0.58
ALDH1A1 P00352 2/20 0.58
LMNA P02545 1/20 0.58
MMP13 P45452 1/20 0.57
ALPL P05186 1/20 0.57
HPGD P15428 1/20 0.56
POLB P06746 1/20 0.55
GAA P10253 1/20 0.55
F10 P00742 2/20 0.55

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
SCHEMBL13175544 0.88 TDP1 (0.69) TDP1MEN1KMT2ASMN1; SMN2MAPK14
SCHEMBL3139963 0.88 TDP1 (0.65) TDP1MEN1KMT2APDE4APDE4B
SCHEMBL4244977 0.87 TDP1 (0.61) TDP1MEN1KMT2APDE4APDE4B
SCHEMBL13175546 0.87 HTR4 (0.69) TDP1MEN1KMT2APDE4APDE4B
SCHEMBL4244608 0.86 TDP1 (0.59) TDP1MEN1KMT2APDE4APDE4B
SCHEMBL3148208 0.85 TDP1 (1.00) TDP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL24162892 0.85 TDP1 (0.58) TDP1MEN1KMT2APDE4APDE4B
SCHEMBL13175812 0.84 HTR4 (0.69) TDP1MEN1KMT2APDE4APDE4B
SCHEMBL4242220 0.83 TDP1 (0.56) TDP1MEN1KMT2APDE4APDE4B
SCHEMBL17758472 0.82 MAPK14 (0.62) TDP1PDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137445-A1 PLANT DISEASE CONTROL AGENT, AND PLANT DISEASE CONTROL METHOD SUMITOMO CHEMICAL COMPANY ,LIMITED 2010-06-03 US disclosed
US-20100137445-A1 PLANT DISEASE CONTROL AGENT, AND PLANT DISEASE CONTROL METHOD SUMITOMO CHEMICAL COMPANY ,LIMITED 2010-06-03 US disclosed
EP-2179651-A1 PLANT DISEASE CONTROL AGENT, AND PLANT DISEASE CONTROL METHOD Sumitomo Chemical Company, Limited (JP) 2010-04-28 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-20100137445-A1 PLANT DISEASE CONTROL AGENT, AND PLANT DISEASE CONTROL METHOD CBR3, CBR1, HDHD5 TDP1 4583/4885MEN1 3173/4885KMT2A 1467/4885

“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.