SCHEMBL28045483

SCHEMBL28045483

C=C[C@]1(NCCCCC)C=CC=CC1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.30
ZDHHC2 Q9UIJ5 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
SCHEMBL3763912 1.00 ZDHHC20 (0.30) ZDHHC20ZDHHC2
SCHEMBL28045615 1.00 ZDHHC20 (0.30) ZDHHC20ZDHHC2
SCHEMBL7704410 0.78
SCHEMBL28853034 0.73 ALDH1A1 (0.32)
SCHEMBL28184157 0.73 ALDH1A1 (0.32)
SCHEMBL1907062 0.72 ALDH1A1 (0.31)
SCHEMBL27702721 0.72
SCHEMBL28793599 0.72
SCHEMBL27702755 0.70 HDAC4 (0.31)
SCHEMBL27723127 0.68 SMN1; SMN2 (0.33)

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
CN-105218392-A L-TARTARIC ACID monoesters monoamide compounds TIANJIN GREENPINE CHINESE MEDICINE PHARMACEUTICAL CO LTD 2016-01-06 CN disclosed