SCHEMBL5570199

SCHEMBL5570199

CCCC[C@@H](C)OC(=O)C(CC)(CC)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.41
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
ALDH1A1 P00352 1/20 0.39
CA2 P00918 2/20 0.36
MAPK1 P28482 1/20 0.36
KDM4E B2RXH2 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LMNA P02545 2/20 0.33
CTSK P43235 2/20 0.33
NAAA Q02083 1/20 0.33
EPHX2 P34913 1/20 0.33
CA1 P00915 1/20 0.33
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
CTSH P09668 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
SCHEMBL7681787 1.00 FAAH (0.41) FAAHCNR1CNR2ALDH1A1CA2
SCHEMBL14645473 0.93 FAAH (0.49) FAAHCNR1CNR2ALDH1A1KDM4E
SCHEMBL182927 0.93 FAAH (0.49) FAAHCNR1CNR2ALDH1A1KDM4E
SCHEMBL7685932 0.93 FAAH (0.49) FAAHCNR1CNR2ALDH1A1KDM4E
SCHEMBL7681782 0.91 FAAH (0.44) FAAHCNR1CNR2ALDH1A1CA2
SCHEMBL8404113 0.89 CHRM1 (0.34) FAAHCNR1CNR2ALDH1A1
SCHEMBL27939909 0.87 FAAH (0.38) FAAHCNR1CNR2ALDH1A1
SCHEMBL7685929 0.84 FAAH (0.53) FAAHCNR1CNR2ALDH1A1KDM4E
SCHEMBL7998405 0.82 FAAH (0.48) FAAHCNR1CNR2ALDH1A1KDM4E
SCHEMBL3531184 0.82 MAPT (0.34) ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070225519-A1 Method for the Production of Optically Active 3-Alkyl Carboxylic Acids and the Intermediate Products Thereof CONSORTIUM FUER ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 2007-09-27 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 (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-20070225519-A1 Method for the Production of Optically Active 3-Alkyl Carboxylic Acids and the Intermediate Products Thereof ME1, ME3, ACMSD FAAH 95/4885CNR1 2498/4885CNR2 1960/4885

“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.