SCHEMBL4647353

SCHEMBL4647353

CC(C)(C)CCCCCCCCCCCCCCCCCCC[O]

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.35
CPT2 P23786 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GGPS1 O95749 1/20 0.32
ACLY P53396 1/20 0.30

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
SCHEMBL5512056 1.00 FFAR1 (0.35) FFAR1CPT2TDP1GGPS1ACLY
SCHEMBL3623704 1.00 FFAR1 (0.35) FFAR1CPT2TDP1GGPS1ACLY
SCHEMBL3202183 1.00 FFAR1 (0.35) FFAR1CPT2TDP1GGPS1ACLY
SCHEMBL17968537 1.00 FFAR1 (0.35) FFAR1CPT2TDP1GGPS1ACLY
SCHEMBL3623149 1.00 FFAR1 (0.35) FFAR1CPT2TDP1GGPS1ACLY
SCHEMBL4643808 1.00 FFAR1 (0.35) FFAR1CPT2TDP1GGPS1ACLY
SCHEMBL3623717 1.00 FFAR1 (0.35) FFAR1CPT2TDP1GGPS1ACLY
SCHEMBL3611826 1.00 FFAR1 (0.35) FFAR1CPT2TDP1GGPS1ACLY
SCHEMBL3613220 1.00 FFAR1 (0.35) FFAR1CPT2TDP1GGPS1ACLY
SCHEMBL4641682 1.00 FFAR1 (0.35) FFAR1CPT2TDP1GGPS1ACLY

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
EP-1443042-B1 HYBRID ONIUM SALT WAKO PURE CHEM IND LTD (JP) 2008-08-13 EP disclosed
US-7101918-B2 Hybrid type onium salt WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2006-09-05 US disclosed
US-20050020710-A1 Hybrid onium salt WAKO PURE CHEMICALS INDUSTRIES, LTD. (JP) 2005-01-27 US disclosed
EP-1443042-A1 HYBRID ONIUM SALT Wako Pure Chemical Industries, Ltd. (JP) 2004-08-04 EP disclosed