SCHEMBL919987

SCHEMBL919987

CCc1cc(Oc2ccc(CN)cc2)ccc1SC

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ST14 Q9Y5Y6 4/20 0.51
MMP2 P08253 5/20 0.36
MMP9 P14780 5/20 0.36
MMP8 P22894 5/20 0.36
MMP14 P50281 5/20 0.36
SLC6A4 P31645 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
MAOB P27338 3/20 0.34
PSIP1 O75475 1/20 0.34
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 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
SCHEMBL9474343 0.80 ST14 (0.53) ST14MMP2MMP9MMP8MMP14
SCHEMBL920787 0.80 ST14 (0.53) ST14MMP2MMP9MMP8MMP14
SCHEMBL919559 0.80 SLC6A4 (0.34) SLC6A4
SCHEMBL921413 0.79 ST14 (0.51) ST14SMN1; SMN2MAOB
SCHEMBL921801 0.78 ST14 (0.55) ST14SLC6A4SMN1; SMN2MAOB
SCHEMBL921520 0.78 PGR (0.48) MMP14SLC6A4
SCHEMBL920620 0.74 ST14 (0.68) ST14MMP2MMP9MMP8MMP14
SCHEMBL920206 0.73 ST14 (0.61) ST14SLC6A4MAOBKEAP1NFE2L2
SCHEMBL919982 0.72 ST14 (0.60) ST14SMN1; SMN2MAOB
SCHEMBL4209153 0.72 ST14 (0.85) ST14MMP2MMP9MMP8MMP14

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-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
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
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 ST14 708/4885MMP2 3626/4885MMP9 2367/4885

“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.