SCHEMBL3135040

SCHEMBL3135040

COc1ccc(C(=O)NC(C)C(C)C)cc1F

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 10/20 0.65
TAS1R1 Q7RTX1 10/20 0.65
LMNA P02545 2/20 0.58
MAPK1 P28482 1/20 0.58
HTT P42858 1/20 0.58
RAB9A P51151 1/20 0.58
ALDH1A1 P00352 2/20 0.53
KCNQ3 O43525 1/20 0.50
KCNQ2 O43526 1/20 0.50
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
GAA P10253 1/20 0.47
PKM P14618 1/20 0.47
PDE4D Q08499 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46
HPGD P15428 1/20 0.45
ANPEP P15144 1/20 0.45

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
SCHEMBL3132875 1.00 TAS1R3 (0.65) TAS1R3TAS1R1LMNAMAPK1HTT
SCHEMBL3145146 0.86 TAS1R3 (0.62) TAS1R3TAS1R1LMNAMAPK1HTT
SCHEMBL3285899 0.80 TAS1R3 (0.47) TAS1R3TAS1R1LMNAMAPK1HTT
SCHEMBL13325344 0.80 TAS1R3 (0.47) TAS1R3TAS1R1LMNAMAPK1HTT
SCHEMBL3138340 0.80 MAPK1 (0.47) TAS1R3TAS1R1LMNAMAPK1ALDH1A1
SCHEMBL3129576 0.80 MAPK1 (0.47) TAS1R3TAS1R1LMNAMAPK1ALDH1A1
SCHEMBL7984450 0.80 LMNA (0.67) TAS1R3TAS1R1LMNAMAPK1HTT
SCHEMBL4203571 0.79 TAS1R3 (1.00) TAS1R3TAS1R1LMNAMAPK1HTT
SCHEMBL402337 0.79 TAS1R3 (0.57) TAS1R3TAS1R1LMNAMAPK1HTT
SCHEMBL702502 0.79 TAS1R3 (0.76) TAS1R3TAS1R1

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 TAS1R3 1105/4885TAS1R1 970/4885LMNA 3993/4885

“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.