SCHEMBL3558271

SCHEMBL3558271

O=S(=O)(c1ccccc1)n1c(-c2ccccc2)cc2cc(F)ccc21

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACLY P53396 17/20 0.67
CA12 O43570 1/20 0.58
CA2 P00918 1/20 0.58
CA9 Q16790 1/20 0.58
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
PTGDR Q13258 1/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.45

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
SCHEMBL14953618 0.91 ACLY (0.61) ACLYCA12CA2CA9PTGDR
SCHEMBL422051 0.87 ACLY (0.54) ACLYCA12CA2CA9ALDH1A1
SCHEMBL14953616 0.85 ACLY (0.70) ACLYCA12CA2CA9
SCHEMBL3558164 0.83 CA12 (0.78) ACLYCA12CA2CA9ALDH1A1
SCHEMBL3567110 0.83 CA12 (0.58) ACLYCA12CA2CA9ALDH1A1
SCHEMBL3555924 0.83 ACLY (0.66) ACLYCA12CA2CA9
SCHEMBL3560088 0.83 ACLY (0.63) ACLYCA12CA2CA9ALDH1A1
SCHEMBL3560737 0.82 PTGDR2 (0.53) ACLYALDH1A1MAPTPTGDRPTGDR2
SCHEMBL424574 0.81 ACLY (0.49) ACLYCA12CA2CA9PTGDR
SCHEMBL17422837 0.81 ACLY (0.46) ACLYCA12CA2CA9PTGDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1567492-B1 N-ARYLSULFONYL-3-AMINOALKOXYINDOLES SUVEN LIFE SCIENCES LTD (IN) 2013-05-22 EP disclosed
US-7718690-B2 N-arylsulfonyl-3-aminoalkoxyindoles RAMAKRISHNA VENKATA SATYA NIROGI 2010-05-18 US disclosed
US-20090131507-A1 N-arylsulfonyl-3-aminoalkoxyindoles SUVEN LIFE SCIENCES LIMITED (IN) 2009-05-21 US disclosed
US-7507835-B2 N-arylsulfonyl-3-aminoalkoxyindoles SUVEN LIFE SCIENCES LTD. (IN) 2009-03-24 US disclosed
US-20060173193-A1 N-arylsulfonyl-3-aminoalkoxyindoles SUVEN LIFE SCIENCES LIMITED (IN) 2006-08-03 US disclosed
CN-1720227-A N-arylsulfonyl-3-aminoalkoxyindoles SUVEN LIFE SCIENCES LTD (IN) 2006-01-11 CN 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-20090131507-A1 N-arylsulfonyl-3-aminoalkoxyindoles HTR3C, HTR3A, AANAT ACLY 4542/4885CA12 4416/4885CA2 3663/4885
US-20060173193-A1 N-arylsulfonyl-3-aminoalkoxyindoles HTR3C, HTR3A, AANAT ACLY 4542/4885CA12 4416/4885CA2 3663/4885

“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.