SCHEMBL17490754

SCHEMBL17490754

CCCOCCOCCOCCOCCC(=O)N[C@@H](Cc1ccccc1)C(=O)NC(CCCCN)C(=O)Nc1ccc(COC(C)=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SSTR3 P32745 1/20 0.54
▸ CALCRL Q16602 2/20 0.52
▸ SIRT1 Q96EB6 9/20 0.45
▸ CHRNA1 P02708 2/20 0.45
▸ CHRNG P07510 2/20 0.45
▸ CHRNB1 P11230 2/20 0.45
▸ CHRND Q07001 2/20 0.45
▸ TLR2 O60603 2/20 0.43
▸ SIRT2 Q8IXJ6 10/20 0.43
▸ SIRT3 Q9NTG7 4/20 0.43

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
SCHEMBL19456877 0.87 SSTR3 (0.54) SSTR3CALCRLSIRT1SIRT2SIRT3
SCHEMBL23651238 0.85 CALCRL (0.51) SSTR3CALCRLCHRNA1CHRNGCHRNB1
SCHEMBL22267518 0.85 CALCRL (0.49) SSTR3CALCRLSIRT1CHRNA1CHRNG
SCHEMBL23651237 0.85 CALCRL (0.51) SSTR3CALCRLCHRNA1CHRNGCHRNB1
SCHEMBL17706674 0.84 SSTR3 (0.55) SSTR3CALCRLSIRT1SIRT2SIRT3
SCHEMBL18494988 0.84 SSTR3 (0.55) SSTR3CALCRLSIRT1SIRT2SIRT3
SCHEMBL14821040 0.84 SSTR3 (0.55) SSTR3CALCRLSIRT1SIRT2SIRT3
SCHEMBL19403504 0.83 SSTR3 (0.54) SSTR3CALCRLSIRT1SIRT2SIRT3
SCHEMBL24829473 0.83 SSTR3 (0.57) SSTR3CALCRLSIRT1SIRT2SIRT3
SCHEMBL22910386 0.82 CALCRL (0.51) SSTR3CALCRLSIRT1SIRT2SIRT3

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-20160030592-A1 Polyoxazoline Antibody Drug Conjugates SERINA THERAPEUTICS (AL), INC. 2016-02-04 — — 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-20160030592-A1 Polyoxazoline Antibody Drug Conjugates FCGR2A, FCGR3B, FCGR1A SSTR3 1343/4885CALCRL 4536/4885SIRT1 3161/4885

“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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