SCHEMBL9015763

SCHEMBL9015763

CCCCCCCC(C)c1ccc(I)cc1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 2/20 0.39
NR1I2 O75469 1/20 0.38
FOLH1 Q04609 4/20 0.38
GPR84 Q9NQS5 1/20 0.36
OPRM1 P35372 1/20 0.35
SPHK1 Q9NYA1 1/20 0.34
CTSK P43235 1/20 0.34
EPHX1 P07099 1/20 0.33
LMNA P02545 1/20 0.33
HTR2A P28223 1/20 0.33

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
SCHEMBL6684351 0.90 SLC2A1 (0.44) SLC2A1NR1I2GPR84OPRM1SPHK1
SCHEMBL9137197 0.90 SLC2A1 (0.44) SLC2A1NR1I2GPR84OPRM1SPHK1
SCHEMBL6678858 0.88 OPRM1 (0.44) SLC2A1NR1I2GPR84OPRM1SPHK1
SCHEMBL9137103 0.84 EPHX1 (0.45) SLC2A1NR1I2GPR84OPRM1SPHK1
SCHEMBL16669127 0.84 EPHX1 (0.45) SLC2A1NR1I2GPR84OPRM1SPHK1
SCHEMBL19361123 0.84 SLC6A2 (0.37)
SCHEMBL13359115 0.84 SLC6A2 (0.37)
SCHEMBL10274464 0.84 SLC6A2 (0.37)
SCHEMBL11516610 0.82 HTT (0.42) SLC2A1NR1I2GPR84OPRM1SPHK1
SCHEMBL10711259 0.82 HTT (0.42) SLC2A1NR1I2GPR84OPRM1SPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5385721-A X-ray radiology and computer tomography; uniform coating of the soft tissues; medical diagnosis STERLING WINTHROP INC. (US) 1995-01-31 US claimed
EP-0609589-A2 Compositions of alkylbenzenes in film-forming materials for visualization of the gastrointestinal tract NYCOMED IMAGING AS (NO) 1994-08-10 EP claimed
EP-0609588-A2 Compositions of alkylbenzenes for visualization of the gastrointestinal tract NYCOMED IMAGING AS (NO) 1994-08-10 EP claimed
US-5334370-A X-ray contrast mixtures for diagnostic radiology consisting of iodo alkylbenzene, a polysaccharide salt or a anionic polymers STERLING WINTHROP INC. (US) 1994-08-02 US claimed
US-5308607-A FOR USE IN DIAGNOSTIC RADIOLOGY STERLING WINTHROP INC. (US) 1994-05-03 US claimed
EP-0746339-A1 X-RAY CONTRAST COMPOSITIONS CONTAINING CELLULOSE DERIVATIVES NYCOMED IMAGING AS (NO) 1996-12-11 EP disclosed
WO-1995022995-A1 X-RAY CONTRAST COMPOSITIONS CONTAINING CELLULOSE DERIVATIVES NYCOMED IMAGING A/S (NO) 1995-08-31 WO disclosed
EP-0609589-A2 Compositions of alkylbenzenes in film-forming materials for visualization of the gastrointestinal tract NYCOMED IMAGING AS (NO) 1994-08-10 EP disclosed
EP-0609588-A2 Compositions of alkylbenzenes for visualization of the gastrointestinal tract NYCOMED IMAGING AS (NO) 1994-08-10 EP disclosed
US-5334370-A X-ray contrast mixtures for diagnostic radiology consisting of iodo alkylbenzene, a polysaccharide salt or a anionic polymers STERLING WINTHROP INC. (US) 1994-08-02 US disclosed
US-5308607-A FOR USE IN DIAGNOSTIC RADIOLOGY STERLING WINTHROP INC. (US) 1994-05-03 US disclosed