SCHEMBL11890609

SCHEMBL11890609

CCCCCCCCCCCCCCCCCCOC(CCCCCCCCCCCCCCCCCC)COC(=O)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ MGLL Q99685 2/20 0.51
▸ CRHBP P24387 1/20 0.50
▸ CRHR2 Q13324 1/20 0.50
▸ HTR2A P28223 1/20 0.47
▸ BCL9 O00512 1/20 0.46
▸ CTNNB1 P35222 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.41
▸ GAA P10253 1/20 0.40
▸ LSS P48449 2/20 0.39
▸ PKM P14618 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL20272357 0.91 MGLL (0.48) MAPTL3MBTL1MGLLCRHBPCRHR2
SCHEMBL16475733 0.91 MGLL (0.48) MAPTL3MBTL1MGLLCRHBPCRHR2
SCHEMBL11890622 0.89 MGLL (0.49) MAPTL3MBTL1MGLLCRHBPCRHR2
SCHEMBL16475721 0.89 MGLL (0.49) MAPTL3MBTL1MGLLCRHBPCRHR2
SCHEMBL30986864 0.85 MGLL (0.56) MAPTL3MBTL1MGLLCRHBPCRHR2
SCHEMBL9846659 0.84 MGLL (0.62) MAPTL3MBTL1MGLLCRHBPCRHR2
SCHEMBL21777065 0.84 MGLL (0.62) MAPTL3MBTL1MGLLCRHBPCRHR2
SCHEMBL21433889 0.84 MGLL (0.62) MAPTL3MBTL1MGLLCRHBPCRHR2
SCHEMBL21433779 0.84 MGLL (0.62) MAPTL3MBTL1MGLLCRHBPCRHR2
SCHEMBL2234364 0.84 MGLL (0.62) MAPTL3MBTL1MGLLCRHBPCRHR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9999673-B2 PEGylated lipids and their use for drug delivery ALNYLAM PHARMACEUTICALS, INC. (US) 2018-06-19 — — US disclosed
EP-3202760-A1 PEGYLATED LIPIDS AND THEIR USE FOR DRUG DELIVERY Alnylam Pharmaceuticals, Inc. (US) 2017-08-09 — — EP disclosed
EP-2663548-B1 PEGYLATED LIPIDS AND THEIR USE FOR DRUG DELIVERY ALNYLAM PHARMACEUTICALS INC (US) 2017-04-05 — — EP disclosed
US-20140200257-A1 PEGYLATED LIPIDS AND THEIR USE FOR DRUG DELIVERY ALNYLAM PHARMACEUTICALS, INC. (US) 2014-07-17 — — US disclosed
US-20140200257-A1 PEGYLATED LIPIDS AND THEIR USE FOR DRUG DELIVERY ALNYLAM PHARMACEUTICALS, INC. (US) 2014-07-17 — — US disclosed
WO-2012099755-A1 PEGYLATED LIPIDS AND THEIR USE FOR DRUG DELIVERY ALNYLAM PHARMACEUTICALS, INC. (US) 2012-07-26 — — WO 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-20140200257-A1 PEGYLATED LIPIDS AND THEIR USE FOR DRUG DELIVERY LIPG, EGFR, LDLR MAPT 1781/4885L3MBTL1 2467/4885MGLL 96/4885

“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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