SCHEMBL30985264

SCHEMBL30985264

C=CCC(CC=C)(CC=C)CNC(=O)CCCCCCCCCCCCCCCCC(=O)OC

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
LMNA P02545 1/20 0.54
RECQL P46063 1/20 0.50
FAAH O00519 2/20 0.44
TSHR P16473 5/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.40
EPHX2 P34913 1/20 0.38
PKM P14618 1/20 0.36
POLB P06746 1/20 0.36
POLA1 P09884 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 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
SCHEMBL30763454 0.84 FAAH (0.63) FAAHTSHRSMN1; SMN2EPHX2MEN1
SCHEMBL30985265 0.83 MAPT (0.47) ALDH1A1LMNAFAAHTSHRSMN1; SMN2
SCHEMBL24013311 0.79 TSHR (0.46) ALDH1A1RECQLFAAHTSHRSMN1; SMN2
SCHEMBL30884807 0.78 TSHR (0.42) ALDH1A1RECQLFAAHTSHRSMN1; SMN2
SCHEMBL24013260 0.75 TSHR (0.39) RECQLFAAHTSHRSMN1; SMN2GAA
SCHEMBL13948797 0.74 RECQL (0.72) ALDH1A1LMNARECQLFAAHTSHR
SCHEMBL31632625 0.74 ALDH1A1 (0.70) ALDH1A1LMNARECQLFAAHTSHR
SCHEMBL30767125 0.74 ALDH1A1 (0.75) ALDH1A1LMNARECQLFAAHTSHR
SCHEMBL24614832 0.73 KMT2A (0.40) ALDH1A1FAAHTSHRSMN1; SMN2MAPT
SCHEMBL196188 0.71 LMNA (1.00) ALDH1A1LMNARECQLTSHRSMN1; SMN2

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
WO-2024143404-A1 ALKYLENE CHAIN-CONTAINING SILANE COMPOUND ダイキン工業株式会社 2024-07-04 WO disclosed