SCHEMBL1986003

SCHEMBL1986003

CC(NC(=O)c1cnc(N)s1)C1CCC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 5/20 0.46
JAK2 O60674 2/20 0.41
JAK1 P23458 2/20 0.41
JAK3 P52333 2/20 0.41
P2RX7 Q99572 2/20 0.41
MAPK1 P28482 1/20 0.41
ACACB O00763 1/20 0.41
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
MMP2 P08253 2/20 0.40
CA9 Q16790 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL1983871 0.97 SMYD3 (0.46) SMYD3JAK2JAK1JAK3P2RX7
SCHEMBL1985456 0.96 JAK2 (0.46) SMYD3JAK2JAK1JAK3P2RX7
SCHEMBL12455912 0.82 TP53 (0.44) MAPK1ACACBSMN1; SMN2ALDH1A1HPGD
SCHEMBL1983158 0.76 LCK (0.39) SMYD3JAK3ACACBCA1CA2
SCHEMBL6907136 0.76 MAPK11 (0.49) SMYD3SMN1; SMN2ALDH1A1HPGD
SCHEMBL11751760 0.75 SMYD3 (0.43) SMYD3JAK2JAK1JAK3P2RX7
SCHEMBL1987603 0.74 ALDH1A1 (0.54) SMYD3MAPK1ACACBCA12CA1
SCHEMBL3657292 0.74 SMYD3 (0.37) SMYD3JAK2JAK1JAK3P2RX7
SCHEMBL4219879 0.73 HDAC1 (0.50) SMN1; SMN2ALDH1A1HPGD
SCHEMBL1987487 0.73 LCK (0.39) SMYD3JAK2JAK1JAK3P2RX7

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 8 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
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
EP-2222655-A1 N-CYCL0ALKYLMETHYL-2-AMIN0THIAZ0LE-5-CARB0XAMIDES FOR USE IN PLANT DISEASE CONTROL Sumitomo Chemical Company, Limited (JP) 2010-09-01 EP 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
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 SMYD3 323/4885JAK2 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.