SCHEMBL9436243

SCHEMBL9436243

C=C(CC)C(=O)OO.CC(=CCCO)C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
CD81 P60033 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
SCHEMBL6312884 0.85 CD81 (0.33) CD81
SCHEMBL9436233 0.80 CYP2D6 (0.36) CYP2D6CYP2C19
SCHEMBL6638068 0.79 CYP2D6 (0.38) CYP2D6CYP2C19CD81
Methacrylic Acid SCHEMBL3667825 0.77 CD81 (0.37) CD81
SCHEMBL30539938 0.77 CD81 (0.37) CD81
Methacrylic Acid SCHEMBL906372 0.77 ALDH1A1 (0.36)
SCHEMBL16092 0.77
SCHEMBL45793 0.77
SCHEMBL28832685 0.77 CD81 (0.41) CD81
Methacrylic Acid SCHEMBL29801788 0.76 CD81 (0.36) CD81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5288804-A Curable coating and film compositions comprising addition or condensation polymers; low water reactivity of aldimine allows crosslinking of aqueous polymer dispersion; quality REICHHOLD CHEMICALS, INC. (US) 1994-02-22 US disclosed
EP-0552469-A2 Acetoacetate aromatic aldimine resin composition REICHHOLD CHEMICALS, INC. (US) 1993-07-28 EP disclosed