SCHEMBL7938332

SCHEMBL7938332

CCOP(=O)(CNCCO)OCC

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.54
TSHR P16473 2/20 0.44
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 2/20 0.34
TP53 P04637 1/20 0.34
ALDH1A1 P00352 1/20 0.31
SAT1 P21673 1/20 0.31
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
PLAU P00749 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
SCHEMBL27807047 0.88 PPARD (0.50) PPARDTSHRCA12CA1CA2
SCHEMBL15532056 0.83 PPARD (0.65) PPARDTSHRCA12CA1CA2
SCHEMBL1980772 0.82 TSHR (0.57) PPARDTSHRCA12CA1CA2
SCHEMBL10583748 0.80 PPARD (0.36) PPARD
SCHEMBL3091452 0.79 TSHR (0.40) PPARDTSHRCA12CA1CA2
SCHEMBL3091711 0.77 TSHR (0.39) PPARDTSHRCA12CA1CA2
SCHEMBL3103138 0.77 TSHR (0.39) PPARDTSHRCA12CA1CA2
SCHEMBL16376895 0.76 TSHR (0.41) PPARDTSHRCA12CA1CA2
SCHEMBL3103051 0.76 CA12 (0.40) PPARDTSHRCA12CA1CA2
Diethyl Hydrogen Phosphate SCHEMBL11442345 0.73 PPARD (0.45) PPARDTSHRCA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113563557-B Polyurethane hard foam heat-insulating material and preparation method thereof 山西誉邦新材料科技有限公司 2022-08-02 CN disclosed
CN-113563557-A Polyurethane hard foam heat-insulating material and preparation method thereof 山西誉邦新材料科技有限公司 2021-10-29 CN disclosed
EP-0742238-B1 Polymer compositions suitable for use as dispersing resins EMTEC MAGNETICS GMBH (DE) 2001-08-08 EP disclosed
EP-0297369-A2 Process for the preparation of N-phosphonomethylglycine HOECHST AKTIENGESELLSCHAFT (DE) 1989-01-04 EP disclosed
EP-0077964-A1 Process for the preparation of flame-resistant and cold-resistant polyurethane foams and their use as inner coatings of storage-tanks BAYER AG (DE) 1983-05-04 EP disclosed