SCHEMBL14656409

SCHEMBL14656409

NC(CCn1ccnn1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.45
DPP4 P27487 1/20 0.44
ARG1 P05089 1/20 0.44
CYP19A1 P11511 6/20 0.39
CYP1A1 P04798 2/20 0.39
ALDH1A1 P00352 1/20 0.39
SLC1A3 P43003 2/20 0.38
GRM5 P41594 2/20 0.38
GRM2 Q14416 2/20 0.38
GSR P00390 2/20 0.38
GRM8 O00222 1/20 0.38
GRM6 O15303 1/20 0.38
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
CYP1A2 P05177 1/20 0.38
GRIK1 P39086 1/20 0.38
GRIA1 P42261 1/20 0.38
GRIA2 P42262 1/20 0.38
GRIA3 P42263 1/20 0.38
SLC1A2 P43004 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
SCHEMBL24233113 1.00 FOLH1 (0.45) FOLH1DPP4ARG1CYP19A1CYP1A1
SCHEMBL14656535 0.90 ARG1 (0.52) FOLH1DPP4ARG1CYP19A1CYP1A1
SCHEMBL5499057 0.86 DPP4 (0.44) FOLH1DPP4ARG1CYP19A1CYP1A1
SCHEMBL5499917 0.86 DPP4 (0.44) FOLH1DPP4ARG1CYP19A1CYP1A1
SCHEMBL5499054 0.85 DPP4 (0.43) FOLH1DPP4ARG1CYP19A1CYP1A1
SCHEMBL5499916 0.85 DPP4 (0.43) FOLH1DPP4ARG1CYP19A1CYP1A1
SCHEMBL27115174 0.85 DPP4 (0.43) FOLH1DPP4ARG1CYP19A1CYP1A1
SCHEMBL6395050 0.82 FOLH1 (0.55) FOLH1CYP19A1CYP1A1SLC1A3
SCHEMBL612982 0.82 FOLH1 (0.55) FOLH1CYP19A1CYP1A1SLC1A3
SCHEMBL18546548 0.76 PADI4 (0.62) CYP19A1CYP1A1ALDH1A1SLC1A1PADI4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130029920-A1 Metal Nanoparticles BRIMBLE MARGARET A (NZ) 2013-01-31 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-20130029920-A1 Metal Nanoparticles PSTPIP2, PCNP, ANPEP FOLH1 352/4885DPP4 924/4885ARG1 2502/4885

“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.