SCHEMBL13799374

SCHEMBL13799374

C[C@H]1CCCCCC2CCCC2C/C=C/C(=O)C1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.32
MAOA P21397 1/20 0.30
MAOB P27338 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
SCHEMBL11205628 0.79 ALDH1A1 (0.43) KMT2A
SCHEMBL11205631 0.79 ALDH1A1 (0.43) KMT2A
SCHEMBL5791644 0.73
SCHEMBL6080709 0.73
SCHEMBL11213716 0.67 ALDH1A1 (0.37)
SCHEMBL11213717 0.67 ALDH1A1 (0.37)
SCHEMBL11213720 0.67 ALDH1A1 (0.37)
SCHEMBL7632266 0.65 DAO (0.33)
SCHEMBL5314209 0.63 ALDH1A1 (0.57) KMT2A
SCHEMBL6155112 0.63 ALDH1A1 (0.47)

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-20090181854-A1 Engineered Glycosyltransferases With Expanded Substrate Specificity WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2009-07-16 US disclosed