SCHEMBL922934

SCHEMBL922934

C#Cc1cccc(Oc2cccc(CNC(=O)O)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.47
HAO1 Q9UJM8 1/20 0.46
MMP13 P45452 2/20 0.45
MAPK14 Q16539 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
GNA15 P30679 1/20 0.43
PTGER3 P43115 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 1/20 0.43
HTT P42858 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
SCHEMBL16397553 0.82 AOC3 (0.55) FFAR1CYP1A2CYP2D6CYP2C9TSHR
SCHEMBL922872 0.81 MMP13 (0.44) FFAR1HAO1MMP13MAPK14SMN1; SMN2
SCHEMBL922758 0.79 FFAR1 (0.49) FFAR1MMP13MAPK14CYP1A2CYP2D6
SCHEMBL922076 0.78 HPGD (0.50) ALDH1A1
SCHEMBL3838122 0.75 HAO1 (0.50) HAO1TSHRTDP1SMN1; SMN2ALDH1A1
SCHEMBL30148747 0.75 HAO1 (0.50) HAO1TSHRTDP1SMN1; SMN2ALDH1A1
SCHEMBL2931410 0.75 MMP13 (0.70) MMP13SMN1; SMN2ALDH1A1HTT
SCHEMBL12908118 0.75 MAOB (0.43) HAO1
SCHEMBL5689227 0.74 LTA4H (0.50) HAO1TSHRTDP1SMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL921005 0.74 MAOB (0.44) HAO1

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 FFAR1 3411/4885HAO1 499/4885MMP13 4062/4885

“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.