SCHEMBL14642695

SCHEMBL14642695

CCCOCCOCCOCCOCCOCCC(=O)NCCCOCCOCCOCCCNC(=O)[C@H](CCCCNC(=O)OCc1ccccc1)NC(=O)OCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 17/20 0.64
▸ SIRT1 Q96EB6 14/20 0.58
▸ SIRT3 Q9NTG7 10/20 0.58
▸ CAPN1 P07384 1/20 0.55
▸ CAPN2 P17655 1/20 0.55
▸ CTSL P07711 1/20 0.55
▸ CTSS P25774 1/20 0.55

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
SCHEMBL14642788 0.98 SIRT2 (0.62) SIRT2SIRT1SIRT3CAPN1CAPN2
SCHEMBL15084866 0.95 SIRT2 (0.61) SIRT2SIRT1SIRT3CAPN1CAPN2
SCHEMBL22055423 0.94 SIRT2 (0.63) SIRT2SIRT1SIRT3CAPN1CAPN2
SCHEMBL15084702 0.94 SIRT2 (0.59) SIRT2SIRT1SIRT3CAPN1CAPN2
SCHEMBL14642694 0.93 SIRT2 (0.59) SIRT2SIRT1SIRT3CAPN1CAPN2
SCHEMBL14240585 0.92 SIRT2 (0.58) SIRT2SIRT1SIRT3CAPN1CAPN2
SCHEMBL14240717 0.92 SIRT2 (0.63) SIRT2SIRT1SIRT3
SCHEMBL14642785 0.91 SIRT2 (0.57) SIRT2SIRT1SIRT3CAPN1CAPN2
SCHEMBL14642700 0.91 SIRT2 (0.57) SIRT2SIRT1SIRT3CAPN1CAPN2
SCHEMBL30094705 0.91 SIRT2 (0.61) SIRT2SIRT1SIRT3CTSLCTSS

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-9393315-B2 Compounds for targeting drug delivery and enhancing siRNA activity NITTO DENKO CORPORATION (JP) 2016-07-19 — — US disclosed
US-20130017249-A1 COMPOUNDS FOR TARGETING DRUG DELIVERY AND ENHANCING siRNA ACTIVITY NITTO DENKO CORPORATION (JP) 2013-01-17 — — 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-20130017249-A1 COMPOUNDS FOR TARGETING DRUG DELIVERY AND ENHANCING siRNA ACTIVITY LDLR, RARG, FABP4 SIRT2 2436/4885SIRT1 1811/4885SIRT3 2925/4885

“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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