SCHEMBL2988405

SCHEMBL2988405

CC(C)(CCCCOCCCCC(C)(C)C(=O)Cl)C(=O)Cl

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.36
CYP4A11 Q02928 2/20 0.36
ACLY P53396 1/20 0.35
ACACB O00763 1/20 0.34
ACACA Q13085 1/20 0.34
CES2 O00748 2/20 0.33
FFAR1 O14842 1/20 0.31
CPT2 P23786 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
PPARA Q07869 2/20 0.31
LTB4R Q15722 3/20 0.31
MEN1 O00255 1/20 0.30
THRB P10828 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
MAPT P10636 1/20 0.30
HRH3 Q9Y5N1 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
SCHEMBL2988784 0.92 CYP4F2 (0.33) CYP4F2CYP4A11ACLYACACBACACA
SCHEMBL2988805 0.86 CYP4F2 (0.58) CYP4F2CYP4A11CES2PPARAMEN1
SCHEMBL22688274 0.84 ACACB (0.35) CYP4F2CYP4A11ACLYACACBACACA
SCHEMBL1114607 0.81 ACLY (0.38) CYP4F2CYP4A11ACLYACACBACACA
Gemcabene SCHEMBL761631 0.80 ACLY (0.55) CYP4F2CYP4A11ACLYACACBACACA
Gemcabene SCHEMBL528316 0.78 ACLY (0.53) CYP4F2CYP4A11ACLYACACBACACA
Gemcabene SCHEMBL4184554 0.78 ACLY (0.53) CYP4F2CYP4A11ACLYACACBACACA
Gemcabene SCHEMBL528317 0.78 CYP4F2 (0.36) CYP4F2CYP4A11ACLYACACBACACA
SCHEMBL6258161 0.78 ACLY (0.53) CYP4F2CYP4A11ACLYACACBACACA
SCHEMBL5531453 0.78 ACLY (0.59) CYP4F2CYP4A11ACLYACACBACACA

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-7777071-B2 Production of carnitine conjugate intermediates SSV THERAPEUTICS, INC. (US) 2010-08-17 US disclosed
US-20090012160-A1 Carnitine Conjugates As Dual Prodrugs, Methods Of Production And Uses Thereof SSV THERAPEUTICS, INC. 2009-01-08 US disclosed
WO-2008018877-A1 CARNITINE CONJUGATES AS DUAL PRODRUGS, METHODS OF PRODUCTION AND USES THEREOF SSV THERAPEUTICS, INC. (US) 2008-02-14 WO 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 (1 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-20090012160-A1 Carnitine Conjugates As Dual Prodrugs, Methods Of Production And Uses Thereof CPT1B, CRAT, CPT2 CYP4F2 102/4885CYP4A11 244/4885ACLY 393/4885

“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.