SCHEMBL1608935

SCHEMBL1608935

CCOC(=O)C(Nc1nc(C2CC2)nc(C(=O)OC)c1Cl)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
PDE10A Q9Y233 5/20 0.40
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
TSHR P16473 2/20 0.35
MAPK1 P28482 1/20 0.35
DHODH Q02127 1/20 0.35
MMP8 P22894 1/20 0.35
SLC6A2 P23975 3/20 0.35
SLC6A3 Q01959 3/20 0.35
SLC6A4 P31645 2/20 0.35
ALDH1A1 P00352 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ELANE P08246 2/20 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
SCHEMBL1609830 0.92 ELANE (0.40) PDE10AKDM4ETSHRMAPK1ALDH1A1
SCHEMBL1609732 0.85 PDE10A (0.39) SMN1; SMN2PDE10AKDM4ETSHRMAPK1
SCHEMBL1609362 0.84 PDE10A (0.40) SMN1; SMN2PDE10AKDM4EL3MBTL1TSHR
SCHEMBL1610170 0.83 PDE10A (0.50) PDE10AKDM4ETSHRMAPK1ALDH1A1
SCHEMBL1610144 0.83 EGFR (0.39) SMN1; SMN2PDE10ATSHRMAPK1ALDH1A1
SCHEMBL1609871 0.83 EGFR (0.39) SMN1; SMN2PDE10ATSHRMAPK1ALDH1A1
SCHEMBL1611523 0.83 EGFR (0.39) SMN1; SMN2PDE10ATSHRMAPK1ALDH1A1
SCHEMBL1609887 0.82 PDE10A (0.40) SMN1; SMN2PDE10AKDM4EL3MBTL1TSHR
SCHEMBL1611075 0.82 L3MBTL1 (0.39) SMN1; SMN2PDE10AKDM4EL3MBTL1TSHR
SCHEMBL1611073 0.82 L3MBTL1 (0.39) SMN1; SMN2PDE10AKDM4EL3MBTL1TSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 US disclosed
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 US disclosed
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 US 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-20110086759-A1 CHEMICAL COMPOUNDS DDT, PNPO, CBR3 SMN1; SMN2 2654/4885PDE10A 1704/4885KDM4E 2613/4885

“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.