SCHEMBL1610144

SCHEMBL1610144

COC(=O)c1nc(C2CC2)nc(N[C@H](CO)c2ccccc2)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.39
PDE10A Q9Y233 2/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
GPR88 Q9GZN0 4/20 0.37
MAP4K3 Q8IVH8 1/20 0.37
MAP4K1 Q92918 1/20 0.37
IRAK4 Q9NWZ3 1/20 0.37
NTRK1 P04629 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
AURKA O14965 2/20 0.36
RPS6KB1 P23443 2/20 0.36
RIPK1 Q13546 1/20 0.36
ALDH1A1 P00352 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ADORA2A P29274 1/20 0.35
CDK1 P06493 2/20 0.35

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
SCHEMBL1611523 1.00 EGFR (0.39) EGFRPDE10ATSHRMAPK1GPR88
SCHEMBL1609871 1.00 EGFR (0.39) EGFRPDE10ATSHRMAPK1GPR88
SCHEMBL1609732 0.92 PDE10A (0.39) PDE10ATSHRMAPK1SMN1; SMN2RPS6KB1
SCHEMBL1609946 0.90 PDE10A (0.37) PDE10ATSHRMAPK1GPR88SMN1; SMN2
SCHEMBL1611032 0.90 PDE10A (0.43) PDE10ATSHRMAPK1SMN1; SMN2ALDH1A1
SCHEMBL1609362 0.87 PDE10A (0.40) PDE10ATSHRMAPK1SMN1; SMN2LMNA
SCHEMBL1610170 0.86 PDE10A (0.50) EGFRPDE10ATSHRMAPK1HPGD
SCHEMBL1609830 0.84 ELANE (0.40) EGFRPDE10ATSHRMAPK1LMNA
SCHEMBL1610314 0.84 PDE10A (0.44) PDE10ATSHRMAPK1SMN1; SMN2ALDH1A1
SCHEMBL1610254 0.84 PDE10A (0.43) EGFRPDE10ATSHRMAPK1CDK1

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 EGFR 724/4885PDE10A 1704/4885TSHR 533/4885

“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.