SCHEMBL3209924

SCHEMBL3209924

O=C(NC1CCc2c(F)cccc21)N(S)CCO

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.41
TAS1R3 Q7RTX0 7/20 0.40
TAS1R1 Q7RTX1 7/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TAS1R2 Q8TE23 6/20 0.38
KDM4C Q9H3R0 3/20 0.36
ALDH1A1 P00352 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.35
XIAP P98170 3/20 0.35
BIRC3 Q13489 2/20 0.35
BIRC2 Q13490 2/20 0.35
ACHE P22303 2/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
P2RX7 Q99572 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
SCHEMBL1999696 0.88 TRPV1 (0.44) PDE10ATAS1R3TAS1R1TAS1R2ALDH1A1
SCHEMBL3223116 0.86 PDE10A (0.41) PDE10ATAS1R3TAS1R1NPSR1TAS1R2
SCHEMBL3219949 0.80 ALDH1A1 (0.53) TAS1R3TAS1R1TAS1R2ALDH1A1
SCHEMBL3219218 0.77 TAS1R3 (0.60) TAS1R3TAS1R1TAS1R2ACHE
SCHEMBL3210493 0.77 ALDH1A1 (0.62) TAS1R3TAS1R1TAS1R2ALDH1A1
SCHEMBL22623413 0.75 KDM4E (0.48) PDE10ATAS1R3TAS1R1NPSR1TAS1R2
SCHEMBL6369376 0.73 EPHX2 (0.46) PDE10ATAS1R3TAS1R1NPSR1TAS1R2
SCHEMBL14040822 0.73 ALDH1A1 (0.43) PDE10ATAS1R3TAS1R1NPSR1TAS1R2
SCHEMBL3209919 0.73 ALDH1A1 (0.43) PDE10ATAS1R3TAS1R1NPSR1TAS1R2
SCHEMBL3209469 0.72 PDE10A (0.41) PDE10ATAS1R3TAS1R1TAS1R2ACHE

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-20100048699-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-02-25 US disclosed
EP-2043444-A1 CHEMICAL COMPOUNDS Syngenta Limited (GB) 2009-04-08 EP disclosed
WO-2008009881-A1 CHEMICAL COMPOUNDS SYNGENTA LIMITED. (GB) 2008-01-24 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-20100048699-A1 CHEMICAL COMPOUNDS ACHE, TYR, SGMS1 PDE10A 1000/4885TAS1R3 816/4885TAS1R1 527/4885

“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.