SCHEMBL21553585

SCHEMBL21553585

C=C/C(=C\C)CC(=O)NC

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.34
LMNA P02545 1/20 0.34
ALDH1A1 P00352 3/20 0.33
TSHR P16473 3/20 0.33
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL18811578 0.82 MCL1 (0.32) MCL1LMNAALDH1A1TSHRMAPK1
SCHEMBL23620096 0.81 GRIK1 (0.33)
SCHEMBL2709395 0.75
SCHEMBL27583200 0.75
SCHEMBL23904591 0.75
SCHEMBL17029657 0.75
SCHEMBL27802762 0.73
SCHEMBL21553579 0.73 CACNA1H (0.33) ALDH1A1TSHRMAPK1TDP1
SCHEMBL8286260 0.71 CNR2 (0.35) MCL1LMNAMAPK1
SCHEMBL19144157 0.70 LMNA (0.35) LMNA

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
EP-2207522-B1 PERSONAL CARE AND HOUSEHOLD PRODUCT COMPOSITIONS COMPRISING SPECIFIC SULFUR CONTAINING STABILISER COMPOUNDS BASF SE (DE) 2019-11-06 EP disclosed