SCHEMBL20380908

SCHEMBL20380908

CCCCNC(=O)CCCCO[C@@H]1OC(COC(C)=O)[C@H](OC(C)=O)C(OC(C)=O)C1NC(C)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ POLB P06746 2/20 0.49
▸ LMNA P02545 3/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ MAPK1 P28482 1/20 0.45
▸ HPSE Q9Y251 5/20 0.43
▸ FGF1 P05230 3/20 0.43
▸ FGF2 P09038 3/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ CA12 O43570 4/20 0.40
▸ CA1 P00915 4/20 0.40
▸ CA2 P00918 4/20 0.40
▸ CA9 Q16790 4/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40

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
SCHEMBL13785542 0.92 CYP3A4 (0.51) CYP3A4MAPTCYP2C9CYP2C19POLB
SCHEMBL21762380 0.92 CYP3A4 (0.53) CYP3A4MAPTCYP2C9CYP2C19POLB
SCHEMBL28380135 0.92 CYP3A4 (0.51) CYP3A4MAPTCYP2C9CYP2C19POLB
SCHEMBL22525087 0.92 CYP3A4 (0.53) CYP3A4MAPTCYP2C9CYP2C19POLB
SCHEMBL21762057 0.92 CYP3A4 (0.53) CYP3A4MAPTCYP2C9CYP2C19POLB
SCHEMBL16217958 0.92 CYP3A4 (0.51) CYP3A4MAPTCYP2C9CYP2C19POLB
SCHEMBL22952982 0.92 CYP3A4 (0.53) CYP3A4MAPTCYP2C9CYP2C19POLB
SCHEMBL22380806 0.91 CYP3A4 (0.50) CYP3A4MAPTCYP2C9CYP2C19POLB
SCHEMBL22688576 0.91 CYP3A4 (0.50) CYP3A4MAPTCYP2C9CYP2C19POLB
SCHEMBL18929669 0.91 CYP3A4 (0.50) CYP3A4MAPTCYP2C9CYP2C19POLB

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-10023861-B2 Oligomer-conjugate complexes and their use IONIS PHARMACEUTICALS, INC. (US) 2018-07-17 — — 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-10023861-B2 Oligomer-conjugate complexes and their use DCLRE1B, NT5C3B, PAICS CYP3A4 4548/4885MAPT 1258/4885CYP2C9 4036/4885

“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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