SCHEMBL2176592

SCHEMBL2176592

CC(C)(C)CCCCCCCCCCCCCC[C]=O

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.31
CPT2 P23786 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ACACB O00763 1/20 0.30
ACACA Q13085 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
SCHEMBL2174177 1.00 FFAR1 (0.31) FFAR1CPT2TDP1ACACBACACA
SCHEMBL2173095 1.00 FFAR1 (0.31) FFAR1CPT2TDP1ACACBACACA
SCHEMBL537432 1.00 FFAR1 (0.31) FFAR1CPT2TDP1ACACBACACA
SCHEMBL2173886 1.00 FFAR1 (0.31) FFAR1CPT2TDP1ACACBACACA
SCHEMBL2173917 1.00 FFAR1 (0.31) FFAR1CPT2TDP1ACACBACACA
SCHEMBL2173350 1.00 FFAR1 (0.31) FFAR1CPT2TDP1ACACBACACA
SCHEMBL2175508 1.00 FFAR1 (0.31) FFAR1CPT2TDP1ACACBACACA
SCHEMBL423932 1.00 FFAR1 (0.31) FFAR1CPT2TDP1ACACBACACA
SCHEMBL2173923 1.00 FFAR1 (0.31) FFAR1CPT2TDP1ACACBACACA
SCHEMBL1824570 1.00 FFAR1 (0.31) FFAR1CPT2TDP1ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7973145-B2 Sulfonated sugar compounds, pharmaceutical compositions which contain the same, and methods of treating tumors with the same TOYO SUISAN KAISHA, LTD. (JP) 2011-07-05 US disclosed
US-20100298246-A1 Sulfonated sugar compounds, pharmaceutical compositions which contain the same, and methods of treating tumors with the same TOYO SUISAN KAISHA, LTD. (JP) 2010-11-25 US disclosed
US-20090209475-A1 Sulfonated sugar compounds, pharmaceutical compositions which contain the same, and methods of treating tumors with the same TOYO SUISAN KAISHA, LTD. (JP) 2009-08-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100298246-A1 Sulfonated sugar compounds, pharmaceutical compositions which contain the same, and methods of treating tumors with the same SLC5A2, SLC5A1, DEGS1 FFAR1 17/4885CPT2 34/4885TDP1 4440/4885
US-20090209475-A1 Sulfonated sugar compounds, pharmaceutical compositions which contain the same, and methods of treating tumors with the same SLC5A2, SLC5A1, DEGS1 FFAR1 17/4885CPT2 34/4885TDP1 4440/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.