SCHEMBL20706554

SCHEMBL20706554

NCCCCC[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCCCOCCOCCOCCCNC(=O)CCOCCOCCOCCOCCOCCC(=O)NCCCOCCOCCOCCCNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NMT1 P30419 6/20 0.48
▸ NMT2 O60551 5/20 0.48
▸ GNAI3 P08754 1/20 0.47
▸ GNAO1 P09471 1/20 0.47
▸ GNAI1 P63096 1/20 0.47
▸ SIRT6 Q8N6T7 1/20 0.46
▸ SIRT1 Q96EB6 1/20 0.46
▸ CD40 P25942 1/20 0.46
▸ GLP1R P43220 8/20 0.43
▸ TLR2 O60603 1/20 0.41

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
SCHEMBL14576026 0.99 NMT1 (0.46) NMT1NMT2GNAI3GNAO1GNAI1
SCHEMBL20272636 0.99 NMT1 (0.46) NMT1NMT2GNAI3GNAO1GNAI1
SCHEMBL18359086 0.98 GNAI3 (0.47) NMT1NMT2GNAI3GNAO1GNAI1
SCHEMBL14707968 0.94 NMT1 (0.47) NMT1NMT2GNAI3GNAO1GNAI1
SCHEMBL14642615 0.94 GNAI3 (0.44) NMT1NMT2GNAI3GNAO1GNAI1
SCHEMBL14642614 0.94 GNAI3 (0.49) NMT1NMT2GNAI3GNAO1GNAI1
SCHEMBL21233587 0.93 NMT1 (0.43) NMT1NMT2GNAI3GNAO1GNAI1
SCHEMBL15084741 0.93 NMT1 (0.42) NMT1NMT2GNAI3GNAO1GNAI1
SCHEMBL20706553 0.91 GNAI3 (0.57) GNAI3GNAO1GNAI1CD40TLR2
SCHEMBL20272608 0.91 GNAI3 (0.57) GNAI3GNAO1GNAI1CD40TLR2

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-10196637-B2 Retinoid-lipid drug carrier NITTO DENKO CORPORATION (JP) 2019-02-05 — — 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-10196637-B2 Retinoid-lipid drug carrier RXRA, RXRG, LRAT NMT1 1232/4885NMT2 1694/4885GNAI3 3028/4885

“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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