SCHEMBL3671682

SCHEMBL3671682

CC(C)CCCCCCCOCCC(C)N(C)C

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 10/20 0.40
▸ CHRNA4 P43681 10/20 0.40
▸ CHRNB4 P30926 7/20 0.40
▸ CHRNA3 P32297 6/20 0.40
▸ SPHK1 Q9NYA1 1/20 0.36
▸ LMNA P02545 1/20 0.34

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
SCHEMBL3681397 1.00 CHRNB2 (0.40) CHRNB2CHRNA4CHRNB4CHRNA3SPHK1
SCHEMBL15199431 0.83 LMNA (0.43) SPHK1LMNA
SCHEMBL10498087 0.82 LMNA (0.48) SPHK1LMNA
SCHEMBL1925735 0.82 LMNA (0.48) SPHK1LMNA
SCHEMBL28371503 0.82 LMNA (0.48) SPHK1LMNA
SCHEMBL23666631 0.82 LMNA (0.48) SPHK1LMNA
SCHEMBL3715852 0.82 LMNA (0.48) SPHK1LMNA
SCHEMBL7763388 0.82 CHRNB2 (0.52) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL398667 0.82 LMNA (0.48) SPHK1LMNA
SCHEMBL8011379 0.82 LMNA (0.48) SPHK1LMNA

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-10736325-B2 Surfactants and formulations MONSANTO TECHNOLOGY LLC (US) 2020-08-11 — — US disclosed
US-20100234228-A1 NOVEL SURFACTANTS AND FORMULATIONS MONSANTO TECHNOLOGY LLC (US) 2010-09-16 — — US disclosed
US-7049270-B2 Potassium glyphosate formulations MONSANTO TECHNOLOGY LLC (US) 2006-05-23 — — US disclosed
US-20050261130-A1 Novel surfactants and formulations MONSANTO TECHNOLOGY LLC (US) 2005-11-24 — — 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 (3 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-20050261130-A1 Novel surfactants and formulations PHOSPHO1, GNMT, DDT CHRNB2 2169/4885CHRNA4 2080/4885CHRNB4 1775/4885
US-20100234228-A1 NOVEL SURFACTANTS AND FORMULATIONS PHOSPHO1, GNMT, DDT CHRNB2 2169/4885CHRNA4 2080/4885CHRNB4 1775/4885
US-10736325-B2 Surfactants and formulations PHOSPHO1, GNMT, DDT CHRNB2 2054/4885CHRNA4 1790/4885CHRNB4 1706/4885

“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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