SCHEMBL440059

SCHEMBL440059

CCCCN(C(C)(C)O)C(C)(C)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.36
CA1 P00915 4/20 0.36
CA9 Q16790 4/20 0.36
ALDH1A1 P00352 2/20 0.36
ALDH2 P05091 1/20 0.36
CA2 P00918 2/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP8 P22894 1/20 0.33
DNM1 Q05193 3/20 0.32
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.32
GGPS1 O95749 2/20 0.31
FDPS P14324 2/20 0.31
AGTR1 P30556 1/20 0.31
OPRM1 P35372 1/20 0.31
PDE3A Q14432 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
THRB P10828 1/20 0.30

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
SCHEMBL10697643 0.92 DNM1 (0.42) CA12CA1CA9ALDH1A1CA2
SCHEMBL438629 0.90 DNM1 (0.46) CA12CA1CA9ALDH1A1CA2
SCHEMBL7760007 0.90 DNM1 (0.46) CA12CA1CA9ALDH1A1CA2
SCHEMBL439209 0.90 DNM1 (0.46) CA12CA1CA9ALDH1A1CA2
SCHEMBL3534539 0.90 DNM1 (0.46) CA12CA1CA9ALDH1A1CA2
SCHEMBL3538819 0.90 DNM1 (0.46) CA12CA1CA9ALDH1A1CA2
SCHEMBL439341 0.90 DNM1 (0.46) CA12CA1CA9ALDH1A1CA2
SCHEMBL438679 0.90 DNM1 (0.46) CA12CA1CA9ALDH1A1CA2
SCHEMBL4799222 0.90 DNM1 (0.46) CA12CA1CA9ALDH1A1CA2
SCHEMBL98702 0.82 CA12 (0.33) CA12CA1CA9ALDH1A1CA2

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 226 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230203067-A1 PRODUCTION PROCESS FOR AMINO ALCOHOLATES COVESTRO DEUTSCHLAND AG (DE) 2023-06-29 US claimed
EP-4161939-A1 PRODUCTION PROCESS FOR AMINO ALCOHOLATES Covestro Deutschland AG (DE) 2023-04-12 EP claimed
WO-2021249887-A1 PRODUCTION PROCESS FOR AMINO ALCOHOLATES COVESTRO DEUTSCHLAND AG (DE) 2021-12-16 WO claimed
EP-3922636-A1 PROCESS FOR PRODUCING AMINOALCOHOLATES Covestro Deutschland AG (DE) 2021-12-15 EP claimed
EP-2692807-B1 AQUEOUS COATING COMPOSITION DAINIPPON TORYO KK (JP) 2019-05-08 EP claimed
EP-2990381-A1 Method for the preparation of tin compounds Covestro Deutschland AG (DE) 2016-03-02 EP claimed
CN-104703962-A Phenoxy alkyl diethanolamine and diisopropanolamine compounds for delivering active agents EMISPHERE TECH INC 2015-06-10 CN claimed
EP-1572773-B1 ORGANOMETALLIC-FREE POLYURETHANES HAVING LOW EXTRACTABLES LUBRIZOL ADVANCED MAT INC (US) 2008-07-09 EP claimed
EP-1262534-B1 Removable pressure sensitive adhesive compositions and sheets NITTO DENKO CORP (JP) 2005-12-21 EP claimed
EP-1198449-B1 PROCESS FOR PREPARING ESTERQUATS AKZO NOBEL NV (NL) 2003-10-15 EP claimed
EP-0085803-B1 A METHOD OF IMPROVING COLD FLOW OF FUEL OILS NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1986-12-30 EP claimed
EP-0117108-B1 METHOD FOR IMPROVING COLD FLOW OF FUEL OILS NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1986-11-05 EP claimed
US-4509954-A ESTERS OF FATTY ACIDS AND THE ADDITION PRODUCT OF AN EPOXIDE AND HYDROXYALKYL AMINE NIPPON OIL AND FATS COMPANY, LTD. (JP) 1985-04-09 US claimed
US-4491455-A ESTERS OF NITROGEN COMPOUNDS NIPPON OIL AND FATS CO., LTD. (JP) 1985-01-01 US claimed
EP-0117108-A2 Method for improving cold flow of fuel oils NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1984-08-29 EP claimed
WO-2024106487-A1 OPTICAL LAMINATE AND IMAGE DISPLAY DEVICE 日東電工株式会社 2024-05-23 WO disclosed
WO-2024106486-A1 ADHESIVE COMPOSITION, ADHESIVE SHEET, OPTICAL MULTILAYER BODY, AND IMAGE DISPLAY DEVICE 日東電工株式会社 2024-05-23 WO disclosed
US-4154779-A HIGH PRESSURE LUBRICANT ADDITIVE, CORROSION RESISTANT; SULFURIZATION, PHOSPHORIZATION, NEUTRALIZATION RHEIN-CHEMIE RHEINAU GMBH (DE) 1979-05-15 US disclosed
US-4142030-A POLYURETHANE-SILICATE BAYER AKTIENGESELLSCHAFT (DE) 1979-02-27 US disclosed
US-4042536-A POLYISOCYANATE, SILICIC ACID, XEROGEL BAYER AKTIENGESELLSCHAFT (DT) 1977-08-16 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-20230203067-A1 PRODUCTION PROCESS FOR AMINO ALCOHOLATES BCAT1, BCAT2, AADAT CA12 629/4885CA1 243/4885CA9 1626/4885

“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.