SCHEMBL769394

SCHEMBL769394

[2H]CC1OCC(n2cc(C)c(NC(=O)c3ccccc3)nc2=O)C(F)C1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 1/20 0.38
▸ RIN1 Q13671 1/20 0.38
▸ CYP2C9 P11712 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ ADORA3 P0DMS8 5/20 0.33
▸ POLB P06746 2/20 0.33
▸ P2RX3 P56373 1/20 0.33
▸ TMIGD3 P0DMS9 2/20 0.32
▸ HTT P42858 1/20 0.32
▸ ADORA1 P30542 3/20 0.32
▸ ADORA2A P29274 2/20 0.32
▸ CTDSP1 Q9GZU7 1/20 0.32
▸ ADORA2B P29275 1/20 0.32
▸ PAX3 P23760 1/20 0.32
▸ FOXO1 Q12778 1/20 0.32
▸ P2RY6 Q15077 1/20 0.32

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
SCHEMBL769771 0.91 ABL1 (0.38) ABL1RIN1CYP2C9MAPTSMN1; SMN2
SCHEMBL769304 0.84 ABL1 (0.51) ABL1RIN1CYP2C9MAPTPOLB
SCHEMBL10075965 0.81 ABL1 (0.38) ABL1RIN1CYP2C9MAPTSMN1; SMN2
SCHEMBL2692847 0.80 MAPT (0.38) ABL1RIN1CYP2C9MAPTSMN1; SMN2
SCHEMBL10075978 0.79 ABL1 (0.37) ABL1RIN1CYP2C9MAPTSMN1; SMN2
SCHEMBL12416129 0.78 ADORA3 (0.36) ABL1RIN1CYP2C9MAPTSMN1; SMN2
SCHEMBL769603 0.77 CYP1A2 (0.32) ABL1RIN1CYP2C9MAPTSMN1; SMN2
SCHEMBL22992440 0.76 ABL1 (0.42) ABL1RIN1CYP2C9MAPTSMN1; SMN2
SCHEMBL769356 0.75 ABL1 (0.51) ABL1RIN1CYP2C9MAPTADORA3
SCHEMBL12416124 0.75 P2RX3 (0.36) ABL1RIN1CYP2C9ADORA3POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130211064-A1 TETRAHYDROPYRAN NUCLEIC ACID ANALOGS ISIS PHARMACEUTICALS, INC. (US) 2013-08-15 — — US disclosed
US-8440803-B2 Tetrahydropyran nucleic acid analogs ISIS PHARMACEUTICALS, INC. (US) 2013-05-14 — — US disclosed
US-20120071645-A1 TETRAHYDROPYRAN NUCLEIC ACID ANALOGS ISIS PHARMACEUTICALS, INC. (US) 2012-03-22 — — US disclosed
US-20120021515-A1 OLIGOMERIC COMPOUNDS AND METHODS ISIS PHARMACEUTICALS, INC. 2012-01-26 — — 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 (2 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-20120021515-A1 OLIGOMERIC COMPOUNDS AND METHODS HNRNPH1, RNASEH1, SNRPE ABL1 4764/4885RIN1 1174/4885CYP2C9 4877/4885
US-20120071645-A1 TETRAHYDROPYRAN NUCLEIC ACID ANALOGS HNRNPM, POLM, RNMT ABL1 4331/4885RIN1 1542/4885CYP2C9 4655/4885

“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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