SCHEMBL5689544

SCHEMBL5689544

CCCCCC(C)(C)N=O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FDPS P14324 11/20 0.43
GGPS1 O95749 7/20 0.43
SMPD1 P17405 5/20 0.40
LPAR1 Q92633 1/20 0.40
LPAR3 Q9UBY5 1/20 0.40
CES2 O00748 1/20 0.35

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
SCHEMBL1262744 0.97 GGPS1 (0.46) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL624318 0.97 GGPS1 (0.46) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL8674346 0.97 GGPS1 (0.46) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL319204 0.97 GGPS1 (0.46) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL7083334 0.97 GGPS1 (0.46) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL409270 0.97 GGPS1 (0.46) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL17941454 0.97 GGPS1 (0.46) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL3968198 0.97 GGPS1 (0.46) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL4436183 0.97 GGPS1 (0.46) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL27338 0.97 GGPS1 (0.46) FDPSGGPS1SMPD1LPAR1LPAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109772226-A One kind by abietyl stabilized with amine oxide surfactant gel emulsion 江南大学 2019-05-21 CN claimed
CN-109627191-A A kind of supramolecular hydrogel of abietyl micro-molecular hydrogel agent and its formation 江南大学 2019-04-16 CN claimed
WO-1995003381-A1 THICKENED HYPOCHLORITE DETERGENT COMPOSITIONS WITH IMPROVED CLEANING PERFORMANCE THE PROCTER & GAMBLE COMPANY (US) 1995-02-02 WO claimed
EP-0635568-A1 Thickened hypochlorite detergent compositions with improved cleaning performance THE PROCTER & GAMBLE COMPANY (US) 1995-01-25 EP claimed
CN-115485431-B Treatment agent for synthetic fibers, and method for treating synthetic fibers 竹本油脂株式会社 2023-09-26 CN disclosed
CN-115485431-A Treating agent for synthetic fiber, and method for treating synthetic fiber 竹本油脂株式会社 2022-12-16 CN disclosed
CN-109627191-B Rosin-based micromolecular hydrogel and supermolecule hydrogel formed by same 江南大学 2020-04-07 CN disclosed
CN-109772226-A One kind by abietyl stabilized with amine oxide surfactant gel emulsion 江南大学 2019-05-21 CN disclosed
CN-109627191-A A kind of supramolecular hydrogel of abietyl micro-molecular hydrogel agent and its formation 江南大学 2019-04-16 CN disclosed
EP-1431316-B1 The in situ polymerization of monoethylenically unsaturated monomers with oligomeric or polymeric secondary amines BAYER MATERIALSCIENCE AG (DE) 2006-03-22 EP disclosed
US-20040122169-A1 Situ polymerization of monoethylenically unsaturated monomers with oligomeric or polymeric secondary amines BAYER AKTIENGESELLSCHAFT (DE) 2004-06-24 US disclosed
US-20040122270-A1 In-situ polymerization of monoethylenically unsaturated monomers with secondary amines BAYER AKTIENGESELLSCHAFT (DE) 2004-06-24 US disclosed
EP-1431316-A1 The in situ polymerization of monoethylenically unsaturated monomers with oligomeric or polymeric secondary amines Bayer MaterialScience AG (DE) 2004-06-23 EP disclosed
EP-1428838-A1 In situ-polymerization of monoethylenically unsaturated monomers with secondary amines Bayer MaterialScience AG (DE) 2004-06-16 EP disclosed
EP-1428837-A1 The in situ polymerization of monoethylenically unsaturated monomers with oligomeric or polymeric secondary amines Bayer MaterialScience AG (DE) 2004-06-16 EP disclosed
EP-1428839-A1 In-situ polymerization of monoethylenically unsaturated monomers with secondary amines Bayer MaterialScience AG (DE) 2004-06-16 EP disclosed
WO-1995003381-A1 THICKENED HYPOCHLORITE DETERGENT COMPOSITIONS WITH IMPROVED CLEANING PERFORMANCE THE PROCTER & GAMBLE COMPANY (US) 1995-02-02 WO disclosed
EP-0635568-A1 Thickened hypochlorite detergent compositions with improved cleaning performance THE PROCTER & GAMBLE COMPANY (US) 1995-01-25 EP disclosed
US-4781748-A AMINE OXIDE PONY INDUSTRIES, INC. (US) 1988-11-01 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-20040122270-A1 In-situ polymerization of monoethylenically unsaturated monomers with secondary amines ALOX5, PARG, FASN FDPS 412/4885GGPS1 295/4885SMPD1 3767/4885

“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.