SCHEMBL4418996

SCHEMBL4418996

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

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
TSHR P16473 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TRPV1 Q8NER1 1/20 0.33
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL10592039 1.00 LMNA (0.40) LMNATSHRNPSR1TRPV1CYP1A2
SCHEMBL4418987 1.00 LMNA (0.40) LMNATSHRNPSR1TRPV1CYP1A2
SCHEMBL8613548 1.00 LMNA (0.40) LMNATSHRNPSR1TRPV1CYP1A2
SCHEMBL10592053 1.00 LMNA (0.40) LMNATSHRNPSR1TRPV1CYP1A2
SCHEMBL4418998 1.00 LMNA (0.40) LMNATSHRNPSR1TRPV1CYP1A2
SCHEMBL8613546 1.00 LMNA (0.40) LMNATSHRNPSR1TRPV1CYP1A2
SCHEMBL10592045 1.00 LMNA (0.40) LMNATSHRNPSR1TRPV1CYP1A2
SCHEMBL3381587 1.00 LMNA (0.40) LMNATSHRNPSR1TRPV1CYP1A2
SCHEMBL11796267 1.00 LMNA (0.40) LMNATSHRNPSR1TRPV1CYP1A2
SCHEMBL3381584 1.00 LMNA (0.40) LMNATSHRNPSR1TRPV1CYP1A2

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
EP-2048953-B1 INSECTICIDAL COMPOSITION MCLAUGHLIN GORMLEY KING CO (US) 2020-11-18 EP disclosed
US-20090324509-A1 INSECTICIDAL COMPOSITION LIVIE BIOPESTICIDES LIMITED (GB) 2009-12-31 US disclosed