SCHEMBL17433013

SCHEMBL17433013

CCCN(CCC(=O)NC)CCN(CCN)CCC(C)=O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TERT O14746 1/20 0.35
ICMT O60725 1/20 0.32
ALB P02768 1/20 0.32
PAOX Q6QHF9 3/20 0.32
LMNA P02545 1/20 0.32
ITGB2 P05107 1/20 0.30
ICAM1 P05362 1/20 0.30
ITGAL P20701 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
SCHEMBL12791551 0.87 LMNA (0.40) ICMTALBLMNA
SCHEMBL12791475 0.85 LMNA (0.41) ICMTALBLMNA
SCHEMBL16638647 0.85 LMNA (0.41) ICMTALBPAOXLMNA
SCHEMBL16638618 0.85 LMNA (0.41) ICMTALBPAOXLMNA
SCHEMBL16504265 0.83 TERT (0.43) TERTICMTALBLMNAITGB2
SCHEMBL12791153 0.83 TERT (0.43) TERTICMTALBLMNAITGB2
SCHEMBL16638623 0.82 PAOX (0.38) TERTICMTALBPAOXLMNA
SCHEMBL12791820 0.78 LMNA (0.36) LMNA
SCHEMBL17433024 0.78 PAOX (0.40) ICMTALBPAOXLMNA
SCHEMBL15870003 0.77 ALDH1A1 (0.45) TERTICMTALBPAOXLMNA

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-20160009657-A1 AMINE-CONTAINING LIPIDS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-01-14 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-20160009657-A1 AMINE-CONTAINING LIPIDS AND USES THEREOF PHOSPHO1, CHMP4B, SGMS1 TERT 1952/4885ICMT 506/4885ALB 891/4885

“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.