SCHEMBL8410248

SCHEMBL8410248

C=CCN(CC=C)CC(=O)OC=C

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
KDM4E B2RXH2 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 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
SCHEMBL3999882 0.81 TSHR (0.43) ALDH1A1KMT2AMEN1KDM4ESMN1; SMN2
SCHEMBL3138082 0.78 ALDH1A1 (0.42) ALDH1A1KMT2AMEN1KDM4ESMN1; SMN2
Water SCHEMBL17193173 0.77 MEN1 (0.33) ALDH1A1KMT2AMEN1KDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL10572746 0.77 ALDH1A1 (0.41) ALDH1A1KMT2AMEN1KDM4ESMN1; SMN2
SCHEMBL4352292 0.75 CA12 (0.48) ALDH1A1KMT2AMEN1KDM4ESMN1; SMN2
SCHEMBL7032684 0.75 ALDH1A1 (0.35) ALDH1A1KMT2AMEN1KDM4ESMN1; SMN2
SCHEMBL11849335 0.75 KDM4E (0.33) ALDH1A1KMT2AMEN1KDM4ESMN1; SMN2
SCHEMBL9249194 0.74 ALDH1A1 (0.41) ALDH1A1KMT2AMEN1KDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL5476790 0.74 CA12 (0.47) ALDH1A1KMT2AMEN1KDM4ESMN1; SMN2
SCHEMBL11348362 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5865951-A USING A NEUTRAL SIZING AGENT AND CATIONIC POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-02 US disclosed