SCHEMBL3388529

SCHEMBL3388529

Cc1ccc(S(=O)(=O)N2C[C@@H]3C[C@@H]3C[C@H]2CN2C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.54
LMNA P02545 3/20 0.54
MAPT P10636 2/20 0.54
RECQL P46063 1/20 0.54
GAA P10253 3/20 0.50
HPGD P15428 3/20 0.50
CYP3A4 P08684 2/20 0.50
KDM4E B2RXH2 2/20 0.50
KMT2A Q03164 4/20 0.44
NPSR1 Q6W5P4 2/20 0.44
MEN1 O00255 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
POLB P06746 1/20 0.44
MCOLN3 Q8TDD5 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
KCNN4 O15554 1/20 0.39
KCNA3 P22001 1/20 0.39

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
SCHEMBL13309088 1.00 ALDH1A1 (0.54) ALDH1A1LMNAMAPTRECQLGAA
SCHEMBL3390663 0.79 POLB (0.53) ALDH1A1LMNAGAAHPGDKMT2A
SCHEMBL3386500 0.79 POLB (0.50) ALDH1A1LMNAGAAKMT2ANPSR1
SCHEMBL13309094 0.77 POLB (0.48) ALDH1A1LMNAGAAHPGDKMT2A
SCHEMBL3390197 0.72 POLB (0.51) ALDH1A1LMNAGAAKMT2ANPSR1
SCHEMBL5411712 0.72 LMNA (0.41) ALDH1A1LMNAMAPTRECQLGAA
SCHEMBL5411706 0.72 LMNA (0.41) ALDH1A1LMNAMAPTRECQLGAA
SCHEMBL14486718 0.71 POLB (0.41) ALDH1A1LMNAMAPTGAAKMT2A
SCHEMBL3388351 0.71 POLB (0.41) ALDH1A1LMNAMAPTGAAKMT2A
SCHEMBL13309091 0.71 POLB (0.41) ALDH1A1LMNAMAPTGAAKMT2A

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-20100144760-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-06-10 US disclosed
US-20100144760-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-06-10 US disclosed
WO-2010063663-A1 N-{[(IR,4S,6R-3-(2-PYRIDINYLCARBONYL)-3-AZABICYCLO [4.1.0]HEPT-4-YL] METHYL}-2-HETEROARYLAMINE DERIVATIVES AND USES THEREOF GLAXO GROUP LIMITED (GB) 2010-06-10 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-20100144760-A1 NOVEL COMPOUNDS HTR3B, HTR1B, HTR2B ALDH1A1 882/4885LMNA 3637/4885MAPT 2636/4885

“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.