SCHEMBL12249043

SCHEMBL12249043

CC(N)CNC(C)CNCCNCC(C)NCC(C)N

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL12249051 1.00 ALDH1A1 (0.30) ALDH1A1
SCHEMBL12248119 0.98
SCHEMBL12249027 0.98
SCHEMBL8659313 0.90 ALDH1A1 (0.33) ALDH1A1
SCHEMBL8343530 0.89 ANPEP (0.42)
SCHEMBL4542114 0.89 ANPEP (0.39) ALDH1A1
SCHEMBL10872778 0.87
SCHEMBL15208704 0.87 ANPEP (0.41)
SCHEMBL15208602 0.87 ANPEP (0.41)
SCHEMBL9079391 0.87 ALDH1A1 (0.39) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9233338-B2 Composition for treating acid gas NALCO COMPANY (US) 2016-01-12 US disclosed
US-20140138578-A1 COMPOSITION FOR TREATING ACID GAS APERGY ESP SYSTEMS, LLC 2014-05-22 US disclosed
US-8318114-B2 Composition for treating acid gas NALCO COMPANY 2012-11-27 US disclosed
US-20110256043-A1 COMPOSITION FOR TREATING ACID GAS PCS FERGUSON, INC. 2011-10-20 US disclosed