SCHEMBL16301130

SCHEMBL16301130

O=C(NC1CCCc2ccccc21)S(=O)(=O)O

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.63
ALDH1A1 P00352 2/20 0.62
TAS1R3 Q7RTX0 3/20 0.61
TAS1R1 Q7RTX1 3/20 0.61
TAS1R2 Q8TE23 3/20 0.61
KMT2A Q03164 3/20 0.60
MEN1 O00255 2/20 0.60
EPHX1 P07099 1/20 0.60
LMNA P02545 3/20 0.60
SMN1; SMN2 Q16637 1/20 0.56
HPGD P15428 1/20 0.56
TSHR P16473 1/20 0.56

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
SCHEMBL9011724 0.81 HTT (0.75) HTTALDH1A1TAS1R3TAS1R1TAS1R2
SCHEMBL1568062 0.81 KMT2A (0.71) HTTALDH1A1TAS1R3TAS1R1TAS1R2
SCHEMBL15824830 0.80 HTT (0.68) HTTALDH1A1TAS1R3TAS1R1TAS1R2
SCHEMBL1441796 0.80 HTT (0.68) HTTALDH1A1TAS1R3TAS1R1TAS1R2
SCHEMBL6445345 0.80 HTT (0.68) HTTALDH1A1TAS1R3TAS1R1TAS1R2
SCHEMBL24334864 0.80 HTT (0.68) HTTALDH1A1TAS1R3TAS1R1TAS1R2
SCHEMBL607818 0.80 HTT (0.68) HTTALDH1A1TAS1R3TAS1R1TAS1R2
SCHEMBL2358933 0.80 HTT (0.68) HTTALDH1A1TAS1R3TAS1R1TAS1R2
SCHEMBL8340594 0.80 HTT (0.68) HTTALDH1A1TAS1R3TAS1R1TAS1R2
SCHEMBL31301105 0.80 HTT (0.68) HTTALDH1A1TAS1R3TAS1R1TAS1R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120076996-A1 RESIST COMPOSITION, RESIST FILM THEREFROM AND METHOD OF FORMING PATTERN THEREWITH FUJIFILM CORPORATION (JP) 2012-03-29 US disclosed