SCHEMBL5275334

SCHEMBL5275334

CCCCCCCCCCCCCCC[C@H](O)[C@H](CC)N(C=O)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.49
CETP P11597 3/20 0.40

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
SCHEMBL5268869 0.87 CSNK1E (0.47) CSNK1ECETP
SCHEMBL16898201 0.85 TLL1 (0.41) CETP
SCHEMBL16898198 0.85 TLL1 (0.41) CETP
SCHEMBL20587176 0.85 TLL1 (0.41) CETP
SCHEMBL7097121 0.78 TLR2 (0.42)
SCHEMBL18241278 0.78 BMP1 (0.53)
SCHEMBL18241280 0.78 BMP1 (0.53)
SCHEMBL16898433 0.77 CTRC (0.39) CETP
SCHEMBL16898430 0.77 CTRC (0.39) CETP
SCHEMBL21498470 0.77 BMP1 (0.50)

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
EP-1287006-B1 ANTITUMORAL COMPOUNDS PHARMA MAR SA (ES) 2007-10-24 EP disclosed
US-7138547-B2 Antitumoral compounds PHARMA MAR, S.A. 2006-11-21 US disclosed
US-20040048834-A1 Antitumoral compounds PHARMA MAR, S.A. (ES) 2004-03-11 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-20040048834-A1 Antitumoral compounds HCCS, MSR1, SUCNR1 CSNK1E 2673/4885CETP 2798/4885

“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.