SCHEMBL28856629

SCHEMBL28856629

CCOC(=O)[C@H](COC(C)(C)C)N=C=O

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.34
ALDH1A1 P00352 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
SCHEMBL28856630 1.00 MAPK1 (0.34) MAPK1ALDH1A1
SCHEMBL30945834 0.87 MAPK1 (0.32) MAPK1
SCHEMBL6896905 0.85 MAPK1 (0.35) MAPK1
SCHEMBL2736223 0.85 MAPK1 (0.35) MAPK1
SCHEMBL30227395 0.84 ALDH1A1 (0.37) MAPK1ALDH1A1
SCHEMBL30409242 0.83 NAAA (0.37) MAPK1ALDH1A1
SCHEMBL30945794 0.82 NAAA (0.39) ALDH1A1
SCHEMBL30945779 0.82 NAAA (0.39) ALDH1A1
SCHEMBL3498626 0.81 MAPK1 (0.38) MAPK1
SCHEMBL3498625 0.81 MAPK1 (0.38) MAPK1

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
EP-4446310-A1 METHOD FOR PRODUCING BLOCKED ISOCYANATE COMPOUND AND METHOD FOR PRODUCING ISOCYANATE COMPOUND Asahi Kasei Kabushiki Kaisha (JP) 2024-10-16 EP disclosed
CN-118382612-A Method for producing blocked isocyanate compound and method for producing isocyanate compound 旭化成株式会社 2024-07-23 CN disclosed
CN-118215651-A Method for producing isocyanate compound, method for producing urethane compound, method for recovering amine compound, and isocyanate composition 旭化成株式会社 2024-06-18 CN disclosed
CN-115190901-A Carbodiimide composition, curing agent composition, coating composition, and resin cured product 旭化成株式会社 2022-10-14 CN disclosed