SCHEMBL921597

SCHEMBL921597

CCOCCOc1ccc[c]c1F

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 8/20 0.42
TDP1 Q9NUW8 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
NCF1 P14598 2/20 0.42
MAPT P10636 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 5/20 0.37
LMNA P02545 3/20 0.37
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KMT2A Q03164 1/20 0.33
PTK2B Q14289 1/20 0.33
POLB P06746 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL920464 0.92 L3MBTL1 (0.46) L3MBTL1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL920097 0.92 L3MBTL1 (0.42) L3MBTL1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL919818 0.90 L3MBTL1 (0.45) L3MBTL1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL920954 0.90 L3MBTL1 (0.45) L3MBTL1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL919867 0.90 L3MBTL1 (0.45) L3MBTL1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL4757078 0.85 L3MBTL1 (0.41) L3MBTL1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL8407096 0.85 L3MBTL1 (0.37) L3MBTL1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL920758 0.84 L3MBTL1 (0.40) L3MBTL1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL160177 0.84 L3MBTL1 (0.46) L3MBTL1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL921028 0.83 CYP1A2 (0.49) L3MBTL1TDP1CYP1A2CYP2D6CYP2C19

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 4 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

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 L3MBTL1 1292/4885TDP1 4034/4885CYP1A2 2625/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 L3MBTL1 779/4885TDP1 3862/4885CYP1A2 2061/4885

“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.