SCHEMBL4182324

SCHEMBL4182324

CN(N)C(=O)CCCCCCCCCCC(=O)NN

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.46
CTSD P07339 1/20 0.45
HDAC3 O15379 2/20 0.43
HDAC1 Q13547 2/20 0.43
HDAC2 Q92769 2/20 0.43
HDAC8 Q9BY41 2/20 0.43
HDAC6 Q9UBN7 2/20 0.43
HDAC5 Q9UQL6 2/20 0.43
HSP90AA1 P07900 1/20 0.41
PHF8 Q9UPP1 2/20 0.40
KDM2A Q9Y2K7 2/20 0.40
KDM4E B2RXH2 1/20 0.40
KDM5C P41229 1/20 0.40
KDM4A O75164 11/20 0.37
KDM4C Q9H3R0 11/20 0.37
KDM5A P29375 1/20 0.37
KDM7A Q6ZMT4 1/20 0.37
DNM1 Q05193 1/20 0.37
HDAC4 P56524 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
SCHEMBL14107095 0.98 CTSD (0.46) ALDH1A1GAACTSDHDAC3HDAC1
SCHEMBL18018692 0.82 ALDH1A1 (0.46) ALDH1A1PHF8KDM2AKDM4AKDM4C
SCHEMBL15129242 0.81 ALDH1A1 (0.48) ALDH1A1GAACTSDHDAC3HDAC1
SCHEMBL20408432 0.80 ALDH1A1 (0.48) ALDH1A1GAACTSDHDAC3HDAC1
SCHEMBL11135108 0.80 PHF8 (0.47) ALDH1A1GAACTSDHDAC3HDAC1
SCHEMBL4186692 0.80 ALDH1A1 (0.67) ALDH1A1GAACTSDHDAC3HDAC1
SCHEMBL10396767 0.80 ALDH1A1 (0.67) ALDH1A1GAACTSDHDAC3HDAC1
SCHEMBL2522480 0.80 ALDH1A1 (0.67) ALDH1A1GAACTSDHDAC3HDAC1
SCHEMBL6636984 0.80 ALDH1A1 (0.67) ALDH1A1GAACTSDHDAC3HDAC1
SCHEMBL183596 0.80 ALDH1A1 (0.67) ALDH1A1GAACTSDHDAC3HDAC1

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-20090143506-A1 Aldehyde inhibitor composition and polyacetal resin composition POLYPLASTICS CO., LTD. (JP) 2009-06-04 US disclosed
EP-1683838-A1 ALDEHYDE INHIBITOR COMPOSITION AND POLYACETAL RESIN COMPOSITION Polyplastics Co., Ltd. (JP) 2006-07-26 EP disclosed