SCHEMBL4782095

SCHEMBL4782095

O=S(=O)(Cl)c1cn(S(=O)(=O)c2ccccc2)c2cccc(Cl)c12

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 18/20 0.48
CYP3A4 P08684 2/20 0.44
CYP2D6 P10635 1/20 0.44
LMNA P02545 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 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
SCHEMBL4783408 0.87 HTR6 (0.47) HTR6CYP3A4CYP2D6LMNAMEN1
SCHEMBL4784316 0.84 HTR6 (0.46) HTR6CYP3A4CYP2D6LMNAMEN1
SCHEMBL4782100 0.84 HTR6 (0.47) HTR6CYP3A4CYP2D6LMNASMN1; SMN2
SCHEMBL4783465 0.82 HTR6 (0.51) HTR6CYP3A4CYP2D6LMNAMEN1
SCHEMBL4781382 0.81 HTR6 (0.43) HTR6CYP3A4CYP2D6LMNAMEN1
SCHEMBL4781323 0.81 HTR6 (0.43) HTR6CYP3A4CYP2D6LMNAMEN1
SCHEMBL4781303 0.81 HTR6 (0.43) HTR6CYP3A4CYP2D6LMNAMEN1
SCHEMBL22864566 0.79 HTR6 (0.60) HTR6CYP3A4CYP2D6LMNAMEN1
SCHEMBL29651295 0.79 HTR6 (0.60) HTR6CYP3A4CYP2D6LMNAMEN1
SCHEMBL4783073 0.78 HTR6 (0.45) HTR6CYP3A4CYP2D6LMNAMEN1

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-8821850-B2 Protein-polymer-drug conjugates MERSANA THERAPEUTICS, INC. (US) 2014-09-02 US disclosed
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO disclosed
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO disclosed