SCHEMBL920681

SCHEMBL920681

N#Cc1ccccc1COc1cc[c]cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.56
MAOB P27338 4/20 0.47
KCNH2 Q12809 1/20 0.46
PLAU P00749 1/20 0.45
ALKBH1 Q13686 1/20 0.44
SPHK2 Q9NRA0 1/20 0.43
ADAMTS4 O75173 1/20 0.43
MMP13 P45452 1/20 0.43
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.40
XDH P47989 1/20 0.40
MMP1 P03956 1/20 0.39
ADAM17 P78536 1/20 0.39

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
SCHEMBL9270379 0.87 FFAR1 (0.64) FFAR1MAOBKCNH2PLAUALKBH1
SCHEMBL921233 0.82 FFAR1 (0.49) FFAR1MAOBKCNH2PLAUALKBH1
SCHEMBL920795 0.81 MAOB (0.46) FFAR1MAOBKCNH2PLAUALKBH1
SCHEMBL15331327 0.78 FFAR1 (0.58) FFAR1MAOBKCNH2PLAUALKBH1
SCHEMBL5793955 0.78 FFAR1 (0.58) FFAR1MAOBKCNH2ALKBH1SPHK2
SCHEMBL28590029 0.78 FFAR1 (0.58) FFAR1MAOBKCNH2ALKBH1SPHK2
SCHEMBL5613168 0.77 MAOB (0.54) FFAR1MAOBKCNH2PLAUALKBH1
SCHEMBL11425815 0.77 FFAR1 (0.44) FFAR1MAOBKCNH2PLAUALKBH1
SCHEMBL15607572 0.76 FFAR1 (0.52) FFAR1MAOBKCNH2PLAUALKBH1
SCHEMBL30765117 0.75 PARP10 (0.63) FFAR1MAOBKCNH2ALKBH1SPHK2

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
US-20110201649-A1 AGRICULTURAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-18 US disclosed
EP-2345328-A1 COMPOSITION FOR AGRICULTURAL USE Sumitomo Chemical Company, Limited (JP) 2011-07-20 EP disclosed
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
US-4198205-A SULFONIC ACID-FREE DISPERSE DYES BASF AKTIENGESELLSCHAFT (DE) 1980-04-15 US 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 (2 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 3411/4885MAOB 3730/4885KCNH2 2433/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 FFAR1 2357/4885MAOB 4351/4885KCNH2 669/4885

“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.