SCHEMBL16403673

SCHEMBL16403673

CC(N)N(CCN)CCN

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37

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
Hydrochloric Acid SCHEMBL3920006 0.97 ALDH1A1 (0.35) ALDH1A1
SCHEMBL12212012 0.85 OPRM1 (0.36) ALDH1A1
SCHEMBL9064141 0.82 CYP2C19 (0.50) ALDH1A1
SCHEMBL4111284 0.82 CYP2C19 (0.50) ALDH1A1
SCHEMBL7164426 0.78 ALDH1A1 (0.32) ALDH1A1
SCHEMBL1626524 0.75 FDPS (0.39) ALDH1A1
SCHEMBL817372 0.75 ALDH1A1 (0.37) ALDH1A1
SCHEMBL816716 0.73 ALDH1A1 (0.35) ALDH1A1
SCHEMBL4889235 0.73 MAPT (0.38) ALDH1A1
SCHEMBL9842431 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3003327-A1 PROTON-BINDING POLYMERS FOR ORAL ADMINISTRATION Tricida Inc. (US) 2016-04-13 EP disclosed
WO-2014197725-A1 PROTON-BINDING POLYMERS FOR ORAL ADMINISTRATION TRICIDA, INC. (US) 2014-12-11 WO disclosed