SCHEMBL1876833

SCHEMBL1876833

CCCCCCCCCC(C)(C)[S+]([O-])CC(O)C[S+]([O-])C(C)(C)CCCCCCCCC

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 6/20 0.33
GPR84 Q9NQS5 3/20 0.33
FDPS P14324 9/20 0.32
SMPD1 P17405 2/20 0.32
CES2 O00748 1/20 0.32
LPAR1 Q92633 1/20 0.32
LPAR3 Q9UBY5 1/20 0.32

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
SCHEMBL11761846 0.75 RIPK1 (0.44)
SCHEMBL1111201 0.73 TSHR (0.40) GGPS1FDPSSMPD1CES2LPAR1
SCHEMBL6601554 0.73 GGPS1 (0.32) GGPS1FDPSSMPD1CES2LPAR1
SCHEMBL30295817 0.70 FDPS (0.36) GGPS1FDPSSMPD1
SCHEMBL18596467 0.67 FDPS (0.34) GGPS1FDPSSMPD1
SCHEMBL28940804 0.65 FDPS (0.50) GGPS1FDPSSMPD1CES2
SCHEMBL28433028 0.65 GGPS1 (0.41) GGPS1FDPSSMPD1CES2LPAR1
SCHEMBL22569218 0.65 GGPS1 (0.41) GGPS1FDPSSMPD1CES2LPAR1
SCHEMBL12514661 0.65 LMNA (0.43) GGPS1FDPSCES2
SCHEMBL158353 0.65 LMNA (0.43) GGPS1FDPSCES2

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-7947831-B2 Sulfoxides or sulfones grafted onto polymers BASF SE Ludwigshafen (DE) 2011-05-24 US disclosed
US-20070015870-A1 Sulfoxides or sulfones grafted onto polymers CIBA CORPORATION 2007-01-18 US disclosed
US-7160955-B2 Sulfoxides or sulfones grafted onto polymers CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-01-09 US disclosed
US-20040152836-A1 Sulfoxides or sulfones grafted onto polymers CIBA SPECIALTY CHEMICALS CORP. 2004-08-05 US disclosed