SCHEMBL921513

SCHEMBL921513

Fc1[c]cccc1OCc1cccs1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.43
GAA P10253 1/20 0.40
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
F9 P00740 1/20 0.35
F10 P00742 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PDK2 Q15119 1/20 0.34
PMP22 Q01453 1/20 0.34
KMT2A Q03164 1/20 0.34
KCNH3 Q9ULD8 1/20 0.34
HPGD P15428 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34

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
SCHEMBL7467771 0.78 HTT (0.45) HTTL3MBTL1GAACYP1A2CYP3A4
SCHEMBL921811 0.74 PARP15 (0.36) ALDH1A1KMT2AHPGDGABRA1GABRG2
SCHEMBL3211927 0.73 MAPT (0.50) L3MBTL1GAAALDH1A1SLC6A3
SCHEMBL920470 0.73 ALDH1A1 (0.50) HTTALDH1A1SMN1; SMN2KMT2AHPGD
SCHEMBL921724 0.73 SMN1; SMN2 (0.50) HTTCYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL445160 0.72 HTT (0.41) HTTL3MBTL1GAAF9F10
SCHEMBL919722 0.72 GAA (0.44) GAACYP2D6ALDH1A1TSHRKMT2A
SCHEMBL921903 0.72 CDK4 (0.48) HTTL3MBTL1ALDH1A1TSHRSMN1; SMN2
SCHEMBL8306329 0.71 SMN1; SMN2 (0.54) HTTL3MBTL1F9F10SMN1; SMN2
SCHEMBL919103 0.71 DHFR (0.45) HTTL3MBTL1GAAALDH1A1SMN1; SMN2

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 HTT 2561/4885L3MBTL1 1292/4885GAA 3332/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 HTT 450/4885L3MBTL1 779/4885GAA 2649/4885

“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.