SCHEMBL9436233

SCHEMBL9436233

C=C(CC)C(=O)OC(=O)C(C)=CCCO

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL28228324 0.88 CYP2D6 (0.34) CYP2D6CYP2C19
SCHEMBL7863676 0.87 CYP2D6 (0.37) CYP2D6CYP2C19
SCHEMBL9577719 0.85 TSHR (0.38) CYP2D6CYP2C19
Ethylene Glycol SCHEMBL27558478 0.84 TSHR (0.37) CYP2D6CYP2C19
SCHEMBL9363621 0.83 CYP2D6 (0.33) CYP2D6CYP2C19
SCHEMBL1534017 0.81 CYP2D6 (0.30) CYP2D6CYP2C19
SCHEMBL9436243 0.80 CYP2D6 (0.31) CYP2D6CYP2C19
SCHEMBL7613779 0.80 EP300 (0.36) CYP2D6CYP2C19
SCHEMBL156660 0.79 TDP1 (0.32)
SCHEMBL9640027 0.79 CYP2D6 (0.31) CYP2D6CYP2C19

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