SCHEMBL4964720

SCHEMBL4964720

COc1ccc(S(=O)(=O)Nc2cnc3ccccc3c2)c2c1CC(NC(=O)C(F)(F)F)CC2

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALPL P05186 17/20 0.55
LMNA P02545 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
SLC22A12 Q96S37 1/20 0.46
ALOX12 P18054 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
SCHEMBL4521478 1.00 ALPL (0.55) ALPLLMNASMN1; SMN2SLC22A12ALOX12
SCHEMBL4510840 0.86 HSD11B1 (0.48)
SCHEMBL4515527 0.85 HTR6 (0.39) ALPLLMNASMN1; SMN2
SCHEMBL4510831 0.85 PKM (0.39)
SCHEMBL4965833 0.85 PKM (0.39)
SCHEMBL4514033 0.84 HSD11B1 (0.39) ALPLLMNASLC22A12
SCHEMBL4518286 0.83 ALPL (0.51) ALPLLMNA
SCHEMBL4514462 0.82 ALDH1A1 (0.48) SMN1; SMN2
SCHEMBL4518619 0.82 ALPL (0.59) ALPLLMNASMN1; SMN2SLC22A12
SCHEMBL4519515 0.82 MTNR1A (0.42)

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
EP-1888518-A1 NOVEL 8-SULFONYL-3 AMINOSUBSTITUTED CHROMAN OR TETRAHYDRONAPHTALENE DERIVATIVES MODULATING THE 5HT6 RECEPTOR AstraZeneca AB (SE) 2008-02-20 EP disclosed
WO-2006126938-A1 NOVEL 8-SULFONYL-3 AMINOSUBSTITUTED CHROMAN OR TETRAHYDRONAPHTALENE DERIVATIVES MODULATING THE 5HT6 RECEPTOR ASTRAZENECA AB (SE) 2006-11-30 WO disclosed