SCHEMBL3049792

SCHEMBL3049792

CCCCCCCOc1ccc(C(=O)C(C)(C)N)cc1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.65
TSHR P16473 1/20 0.65
PLA2G4B P0C869 6/20 0.63
RARB P10826 3/20 0.60
PLA2G4A P47712 1/20 0.57
GAA P10253 2/20 0.56
NPC1 O15118 1/20 0.56
LMNA P02545 1/20 0.56
MAPT P10636 1/20 0.56
ALOX15 P16050 1/20 0.56
RAB9A P51151 1/20 0.56
HSD17B10 Q99714 1/20 0.56
S1PR4 O95977 2/20 0.55
S1PR1 P21453 2/20 0.55
S1PR3 Q99500 2/20 0.55
S1PR5 Q9H228 1/20 0.55
THRA P10827 1/20 0.55
THRB P10828 1/20 0.55
NR5A1 Q13285 1/20 0.54

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
SCHEMBL13246802 0.88 TP53 (0.69) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL13246798 0.88 TP53 (0.69) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL15503238 0.88 TP53 (0.69) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL13246800 0.88 TP53 (0.69) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL13246801 0.88 TP53 (0.69) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL13246799 0.88 TP53 (0.69) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL5039752 0.86 TP53 (0.67) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL5047352 0.86 TP53 (0.67) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL15000394 0.86 TP53 (0.67) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL10711491 0.86 TP53 (0.67) TP53TSHRPLA2G4BRARBPLA2G4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1959742-B1 FUNGICIDAL COMPOSITION CONTAINING CARBOXYLIC ACID AMIDE DERIVATIVE ISHIHARA SANGYO KAISHA (JP) 2016-11-02 EP disclosed
US-8420572-B2 Fungicidal composition containing carboxylic acid amide derivative ISHIHARA SANGYO KAISHA, LTD. (JP) 2013-04-16 US disclosed
US-20100222337-A1 FUNGICIDAL COMPOSITION CONTAINING CARBOXYLIC ACID AMIDE DERIVATIVE ISHIHARA SANGYO KAISHA, LTD. (JP) 2010-09-02 US disclosed
EP-1959742-A2 FUNGICIDAL COMPOSITION CONTAINING CARBOXYLIC ACID AMIDE DERIVATIVE ISHIHARA SANGYO KAISHA, LTD. (JP) 2008-08-27 EP disclosed
WO-2007069777-A2 FUNGICIDAL COMPOSITION CONTAINING CARBOXYLIC ACID AMIDE DERIVATIVE ISHIHARA SANGYO KAISHA, LTD. (JP) 2007-06-21 WO 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-20100222337-A1 FUNGICIDAL COMPOSITION CONTAINING CARBOXYLIC ACID AMIDE DERIVATIVE CNPY2, CBR3, ACOX3 TP53 4498/4885TSHR 1896/4885PLA2G4B 2701/4885

“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.