SCHEMBL12009951

SCHEMBL12009951

CCC(C)(C)CCOC(=O)CCN1CCC(CC2CCN(CCC(=O)OCCC(C)C)C2)C1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ARG1 P05089 1/20 0.31
▸ ARG2 P78540 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ LTA4H P09960 1/20 0.31
▸ CNR1 P21554 1/20 0.30
▸ CNR2 P34972 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
SCHEMBL15314276 0.93 SMN1; SMN2 (0.35) ARG1ARG2SMN1; SMN2LTA4H
SCHEMBL13730325 0.90 SMN1; SMN2 (0.33) ARG1ARG2SMN1; SMN2LTA4H
SCHEMBL14472771 0.85 — —
SCHEMBL12181288 0.80 CHRM1 (0.33) ARG1ARG2SMN1; SMN2
SCHEMBL13510862 0.79 SMN1; SMN2 (0.35) ARG1ARG2SMN1; SMN2
SCHEMBL421373 0.78 ALDH1A1 (0.40) SMN1; SMN2LTA4H
SCHEMBL19102455 0.77 SMN1; SMN2 (0.36) SMN1; SMN2
SCHEMBL10074652 0.75 CYP19A1 (0.35) SMN1; SMN2
SCHEMBL12650302 0.75 ALDH1A1 (0.32) —
SCHEMBL12181600 0.74 SMN1; SMN2 (0.35) ARG1ARG2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE43612-E1 Biodegradable poly(β-amino esters) and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-08-28 — — US disclosed
US-20110059172-A1 THERAPEUTIC COMPOSITIONS TZIANABOS ARTHUR 2011-03-10 — — 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-20110059172-A1 THERAPEUTIC COMPOSITIONS PHOSPHO1, ACP1, TUBB3 ARG1 63/4885ARG2 73/4885SMN1; SMN2 409/4885

“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.

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