SCHEMBL3561901

SCHEMBL3561901

Cc1cc2ccccc2n1S(=O)(=O)c1ccccc1Br

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACLY P53396 6/20 0.46
HTR6 P50406 9/20 0.43
CA2 P00918 2/20 0.42
CA1 P00915 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CHRM1 P11229 1/20 0.41
PLCG1 P19174 1/20 0.40
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CA12 O43570 1/20 0.39
CA9 Q16790 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
SCHEMBL14953556 0.87 ACLY (0.46) ACLYHTR6CA2TSHRKMT2A
SCHEMBL14953494 0.82 ACLY (0.43) ACLYHTR6CA2TSHRKMT2A
SCHEMBL3563939 0.81 ACLY (0.62) ACLYCA2KMT2ACA12CA9
SCHEMBL3563271 0.77 CA12 (0.56) HTR6CA2TSHRKMT2ACA12
SCHEMBL5029975 0.76 CCR2 (0.44) ACLYCA2TSHRCA12CA9
SCHEMBL14732435 0.75 FABP3 (0.58) HTR6CA2CA1CA4CA6
SCHEMBL6829699 0.75 HTR6 (0.60) HTR6CHRM1
SCHEMBL28414053 0.74 NOD1 (0.61) HTR6CA2CA1KMT2AHSD17B10
SCHEMBL8999447 0.74 RAPGEF4 (0.39) ACLYCA2TSHRKMT2ACA12
SCHEMBL27598460 0.74 ACLY (0.41) ACLYTSHRKMT2A

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 4542/4885HTR6 56/4885CA2 3663/4885
US-20060173193-A1 N-arylsulfonyl-3-aminoalkoxyindoles HTR3C, HTR3A, AANAT ACLY 4542/4885HTR6 56/4885CA2 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.