SCHEMBL8926509

SCHEMBL8926509

CCCCNC(=O)NS(=O)(=O)c1ccoc1C(=O)OC

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.59
CYP2C9 P11712 4/20 0.51
ALDH1A1 P00352 2/20 0.51
LMNA P02545 1/20 0.51
ALB P02768 1/20 0.51
TSHR P16473 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
CYP2C19 P33261 2/20 0.49
FBP1 P09467 1/20 0.47
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TBXA2R P21731 11/20 0.43

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
SCHEMBL11119863 0.78 HTT (0.58) HTTCYP2C9ALDH1A1LMNAALB
SCHEMBL8927335 0.76 HTT (0.56) HTTCYP2C9ALDH1A1LMNAALB
SCHEMBL9137951 0.74 HTT (0.54) HTTCYP2C9ALDH1A1LMNAALB
SCHEMBL10626084 0.73 HTT (0.67) HTTCYP2C9ALDH1A1LMNAALB
SCHEMBL16758296 0.71 CYP2C9 (0.62) HTTCYP2C9ALDH1A1LMNAALB
SCHEMBL10753890 0.71 GAA (0.57) ALDH1A1KMT2A
SCHEMBL10642741 0.69 CYP2C9 (0.56) HTTCYP2C9ALDH1A1LMNAALB
SCHEMBL8446527 0.69 CYP2C9 (0.55) HTTCYP2C9ALDH1A1LMNAALB
SCHEMBL8672864 0.69 TBXA2R (0.55) HTTCYP2C9ALDH1A1LMNAALB
SCHEMBL184964 0.69 CYP2C9 (0.76) CYP2C9ALDH1A1LMNAALBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5608143-A NUCLEIC ACID PROMOTER FRAGMENT E. I. DU PONT DE NEMOURS AND COMPANY (US) 1997-03-04 US disclosed
US-5364780-A Genetic engineering with DNA and promoters E. I. DU PONT DE NEMOURS AND COMPANY (US) 1994-11-15 US disclosed
EP-0463056-A1 EXTERNAL REGULATION OF GENE EXPRESSION E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-01-02 EP disclosed
WO-1990011361-A1 EXTERNAL REGULATION OF GENE EXPRESSION E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-10-04 WO disclosed