SCHEMBL3261992

SCHEMBL3261992

CCCCCc1ccc2nc(C3CCCN3C(=O)OCc3ccccc3)sc2c1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AADAT Q8N5Z0 5/20 0.52
PRCP P42785 1/20 0.45
TMEM97 Q5BJF2 3/20 0.44
SIGMAR1 Q99720 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.41
GFER P55789 1/20 0.41
HSD11B1 P28845 1/20 0.41
PREP P48147 1/20 0.41

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
SCHEMBL3261980 1.00 AADAT (0.52) AADATPRCPTMEM97SIGMAR1SMN1; SMN2
SCHEMBL3226009 0.84 AADAT (0.56) AADATTMEM97SIGMAR1SMN1; SMN2HSD11B1
SCHEMBL3225994 0.84 AADAT (0.56) AADATTMEM97SIGMAR1SMN1; SMN2HSD11B1
SCHEMBL3264197 0.81 SMN1; SMN2 (0.46) AADATPRCPTMEM97SIGMAR1SMN1; SMN2
SCHEMBL3264198 0.81 SMN1; SMN2 (0.46) AADATPRCPTMEM97SIGMAR1SMN1; SMN2
SCHEMBL14160545 0.80 AADAT (0.50) AADATTMEM97SIGMAR1HSD11B1PREP
SCHEMBL21206505 0.79 AADAT (0.62) AADATTMEM97SIGMAR1GFERPREP
SCHEMBL3220063 0.78 AADAT (0.48) AADATTMEM97SIGMAR1HSD11B1PREP
SCHEMBL3220048 0.78 AADAT (0.48) AADATTMEM97SIGMAR1HSD11B1PREP
SCHEMBL14117159 0.77 AADAT (0.50) AADATTMEM97SIGMAR1SMN1; SMN2NPSR1

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-20100055071-A1 Anti-Viral Compounds SMITHKLINE BEECHAM CORPORATION 2010-03-04 US disclosed
US-20080193411-A1 Anti-viral Compounds GENELABS TECHNOLOGIES, INC. 2008-08-14 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 (2 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-20080193411-A1 Anti-viral Compounds ZC3HAV1, ZC3HAV1L, SARS1 AADAT 2338/4885PRCP 983/4885TMEM97 4201/4885
US-20100055071-A1 Anti-Viral Compounds ZC3HAV1, ZC3HAV1L, SARS1 AADAT 2338/4885PRCP 983/4885TMEM97 4201/4885

“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.