SCHEMBL1987487

SCHEMBL1987487

C[C@H](NC(=O)c1cnc(NC(=O)OC(C)(C)C)s1)C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LCK P06239 2/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
JAK3 P52333 1/20 0.39
MAPK1 P28482 3/20 0.38
P2RX7 Q99572 1/20 0.38
SMYD3 Q9H7B4 2/20 0.38
CA1 P00915 3/20 0.37
CA2 P00918 3/20 0.37
CA12 O43570 2/20 0.37
MMP2 P08253 2/20 0.37
CA9 Q16790 2/20 0.37
HRH3 Q9Y5N1 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
FPR3 P25089 1/20 0.36
FPR2 P25090 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
SCHEMBL1983158 0.97 LCK (0.39) LCKJAK3SMYD3CA1CA2
SCHEMBL19914222 0.81 LCK (0.43) LCKJAK3CA1CA2FPR3
SCHEMBL1990109 0.79 LCK (0.53) LCKSMN1; SMN2
SCHEMBL1985456 0.77 JAK2 (0.46) JAK2JAK1JAK3MAPK1P2RX7
SCHEMBL949743 0.76 CA1 (0.44) LCKCA1CA2
SCHEMBL27360278 0.76 CCNE1 (0.43) LCKCA1CA2
SCHEMBL1983871 0.75 SMYD3 (0.46) JAK2JAK1JAK3MAPK1P2RX7
SCHEMBL1989018 0.75 HDAC3 (0.44) LCKSMN1; SMN2FPR3FPR2
SCHEMBL29632538 0.74 KDM4E (0.51) LCKSMN1; SMN2
SCHEMBL12715493 0.74 CCNE1 (0.50) LCKCA1CA2SMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2222655-B1 N-CYCL0ALKYLMETHYL-2-AMIN0THIAZ0LE-5-CARB0XAMIDES FOR USE IN PLANT DISEASE CONTROL SUMITOMO CHEMICAL CO (JP) 2011-06-29 EP disclosed
US-20100298391-A1 AMIDE COMPOUNDS AND USE THEREOF FOR PLANT DISEASE CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-25 US disclosed
US-20100298391-A1 AMIDE COMPOUNDS AND USE THEREOF FOR PLANT DISEASE CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-25 US disclosed
US-20100298391-A1 AMIDE COMPOUNDS AND USE THEREOF FOR PLANT DISEASE CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-25 US disclosed
WO-2009066790-A1 N-CYCL0ALKYLMETHYL-2-AMIN0THIAZ0LE-5-CARB0XAMIDES FOR USE IN PLANT DISEASE CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-05-28 WO 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-20100298391-A1 AMIDE COMPOUNDS AND USE THEREOF FOR PLANT DISEASE CONTROL CYC1, NAT1, CYCS LCK 2767/4885JAK2 2625/4885JAK1 1918/4885

“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.