SCHEMBL1703329

SCHEMBL1703329

CCC(CN)CC(C)CCCC(O)CCCC(C)CC(CC)CN

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL14564100 0.98 ALDH1A1 (0.41) ALDH1A1TDP1
SCHEMBL8921152 0.88 ALDH1A1 (0.33) ALDH1A1
SCHEMBL13679347 0.84 LMNA (0.46) ALDH1A1TDP1
SCHEMBL23772032 0.82 ALDH1A1 (0.64) ALDH1A1TDP1
SCHEMBL6903881 0.82 ALDH1A1 (0.46) ALDH1A1TDP1
SCHEMBL23710711 0.82 ALDH1A1 (0.64) ALDH1A1TDP1
SCHEMBL8320000 0.77 ALDH1A1 (0.50) ALDH1A1TDP1
SCHEMBL10765370 0.77 ALDH1A1 (0.44) ALDH1A1TDP1
SCHEMBL21703580 0.77 ALDH1A1 (0.50) ALDH1A1TDP1
SCHEMBL23696604 0.76 ALDH1A1 (0.56) ALDH1A1TDP1

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-20120088886-A1 PROCESSES FOR THE PREPARATION OF SEVELAMER CARBONATE Watson Pharma Private Limited (IN) 2012-04-12 US disclosed