SCHEMBL3337600

SCHEMBL3337600

FC(F)(F)c1ncc(-c2ccc3c(c2)CCNC3)cn1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 6/20 0.60
DRD2 P14416 1/20 0.42
DRD3 P35462 1/20 0.42
CD274 Q9NZQ7 3/20 0.41
PNMT P11086 2/20 0.41
MCHR1 Q99705 2/20 0.39
TLR9 Q9NR96 1/20 0.39
TLR8 Q9NR97 1/20 0.39
TLR7 Q9NYK1 1/20 0.39
CD44 P16070 1/20 0.39
MAOB P27338 1/20 0.39
MAP4K1 Q92918 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
Hydrochloric Acid SCHEMBL31022070 0.78 ASIC3 (0.74) ASIC3DRD2DRD3CD274PNMT
SCHEMBL587208 0.77 ASIC3 (0.60) ASIC3DRD2DRD3CD274PNMT
SCHEMBL27721456 0.76 ASIC3 (0.59) ASIC3DRD2DRD3CD274PNMT
Hydrochloric Acid SCHEMBL588201 0.75 ASIC3 (0.58) ASIC3DRD2DRD3CD274PNMT
SCHEMBL27700750 0.75 ASIC3 (0.58) ASIC3DRD2DRD3CD274PNMT
Hydrochloric Acid SCHEMBL587643 0.74 ASIC3 (0.56) ASIC3DRD2DRD3CD274PNMT
SCHEMBL2675790 0.73 ASIC3 (0.67) ASIC3DRD2DRD3PNMT
SCHEMBL27928333 0.72 ASIC3 (0.58) ASIC3DRD2DRD3CD274TLR9
SCHEMBL1011047 0.72 ASIC3 (0.58) ASIC3DRD2DRD3CD274PNMT
SCHEMBL1010614 0.72 ASIC3 (0.61) ASIC3DRD2DRD3CD274PNMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7700604-B2 Hydantoin derivatives as metalloproteinase inhibitors ASTRAZENECA AB (SE) 2010-04-20 US disclosed
US-20080032997-A1 Novel Hydantoin Derivatives as Metalloproteinase Inhibitors ASTRAZENECA AB (SE) 2008-02-07 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-20080032997-A1 Novel Hydantoin Derivatives as Metalloproteinase Inhibitors MMP1, MMP2, MMP9 ASIC3 3925/4885DRD2 2638/4885DRD3 2849/4885

“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.