SCHEMBL8928176

SCHEMBL8928176

CC(O)CC(CN(CCNC(=O)O)CC(C)O)NC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL8928172 0.73 CYP2D6 (0.32) CYP2D6CYP2C19
SCHEMBL9467784 0.70
SCHEMBL16767203 0.69 CYP2D6 (0.31) CYP2D6CYP2C19
SCHEMBL15552357 0.67 CA12 (0.44) CYP2D6CYP2C19
SCHEMBL6260907 0.65 KDM4E (0.33) CYP2C19
SCHEMBL24688432 0.64 ALDH1A1 (0.39)
SCHEMBL2835194 0.64 ALDH1A1 (0.49) CYP2D6CYP2C19
SCHEMBL24572104 0.64 KDM4E (0.32) CYP2C19
SCHEMBL14980610 0.64 KDM4E (0.32) CYP2C19
SCHEMBL13045063 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0495269-B1 Thermosetting reactive resin mixture, moulded article and coating made therefrom DAINIPPON INK & CHEMICALS (JP) 1997-03-05 EP disclosed
US-5292833-A Polyepoxide compound, carbamate compound and catalyst DAINIPPON INK AND CHEMICALS, INC. (JP) 1994-03-08 US disclosed
US-5258514-A For thermosetting resins AMERICAN CYANAMID COMPANY (US) 1993-11-02 US disclosed
EP-0246483-B1 URETHANE-FUNCTIONAL S-TRIAZINE CROSSLINKING AGENTS AND CURABLE COMPOSITIONS CONTAINING THE SAME AMERICAN CYANAMID COMPANY (US) 1993-03-17 EP disclosed
US-5138055-A Urethane-functional s-triazine crosslinking agents AMERICAN CYANAMID COMPANY (US) 1992-08-11 US disclosed
WO-1992012192-A2 THERMOSETTING REACTIVE RESIN MIXTURE, MOULDED ARTICLE AND COATING MADE THEREFROM DAINIPPON INK & CHEMICALS, INC. (JP) 1992-07-23 WO disclosed
EP-0495269-A2 Thermosetting reactive resin mixture, moulded article and coating made therefrom DAINIPPON INK AND CHEMICALS, INC. (JP) 1992-07-22 EP disclosed
US-4742118-A THERMOSETTABLE; LIGHT STABLE COATINGS AMERICAN CYANAMID COMPANY (US) 1988-05-03 US disclosed
EP-0246483-A2 Urethane-functional s-triazine crosslinking agents and curable compositions containing the same AMERICAN CYANAMID COMPANY (US) 1987-11-25 EP disclosed