SCHEMBL920050

SCHEMBL920050

CCc1cccc(Oc2c[c]ccc2)c1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
KDM4E B2RXH2 4/20 0.40
TDP1 Q9NUW8 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
SOD1 P00441 1/20 0.39
TSHR P16473 2/20 0.38
MAPK1 P28482 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
TP53 P04637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HTT P42858 1/20 0.37
CETP P11597 2/20 0.36
CTSD P07339 1/20 0.36
BACE1 P56817 1/20 0.36

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
SCHEMBL922033 0.84 LTA4H (0.41) SMN1; SMN2TP53
SCHEMBL4911820 0.84 IDO1 (0.42) ALDH1A1KDM4ETDP1SMN1; SMN2HTT
SCHEMBL9488681 0.84 ALDH1A1 (0.50) ALDH1A1KDM4ETDP1SMN1; SMN2SOD1
SCHEMBL30358275 0.84 ALDH1A1 (0.50) ALDH1A1KDM4ETDP1SMN1; SMN2SOD1
SCHEMBL23932329 0.83 ST14 (0.43) ALDH1A1SMN1; SMN2
SCHEMBL6153735 0.83 LTA4H (0.42) SMN1; SMN2TSHRHSD17B10
SCHEMBL921840 0.83 ALDH1A1 (0.45) ALDH1A1KDM4ETDP1SMN1; SMN2SOD1
SCHEMBL11736722 0.80 ALDH1A1 (0.53) ALDH1A1KDM4ETDP1SMN1; SMN2SOD1
SCHEMBL921385 0.80 TP53 (0.47) ALDH1A1KDM4ETDP1SMN1; SMN2TSHR
SCHEMBL5407250 0.78 KDM4E (0.58) ALDH1A1KDM4ETDP1SMN1; SMN2TSHR

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 ALDH1A1 2743/4885KDM4E 3657/4885TDP1 4034/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 ALDH1A1 4326/4885KDM4E 3733/4885TDP1 3862/4885

“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.