SCHEMBL6058124

SCHEMBL6058124

C#CCN1CC(=O)N(COC(=O)[C@H]2[C@@H](C=C(C)C)C2(C)C)C1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 1.00
CYP1A2 P05177 3/20 0.39
CYP2C19 P33261 3/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
TDP1 Q9NUW8 2/20 0.37
TSHR P16473 3/20 0.34
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL6058126 1.00 LMNA (1.00) LMNACYP1A2CYP2C19CYP3A4CYP2D6
SCHEMBL2114338 1.00 LMNA (1.00) LMNACYP1A2CYP2C19CYP3A4CYP2D6
SCHEMBL29713755 1.00 LMNA (1.00) LMNACYP1A2CYP2C19CYP3A4CYP2D6
SCHEMBL25197 1.00 LMNA (1.00) LMNACYP1A2CYP2C19CYP3A4CYP2D6
SCHEMBL11507284 0.92 LMNA (0.85) LMNACYP1A2CYP2C19CYP3A4CYP2D6
SCHEMBL12318209 0.91 LMNA (0.83) LMNACYP1A2CYP2C19CYP3A4CYP2D6
SCHEMBL11509999 0.91 LMNA (0.83) LMNACYP1A2CYP2C19CYP3A4CYP2D6
SCHEMBL11506764 0.90 LMNA (0.82) LMNACYP1A2CYP2C19CYP3A4CYP2D6
SCHEMBL13198757 0.90 LMNA (0.82) LMNACYP1A2CYP2C19CYP3A4CYP2D6
SCHEMBL14210576 0.90 LMNA (0.82) LMNACYP1A2CYP2C19CYP3A4CYP2D6

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-0823213-B1 Insecticidal aerosol composition and insecticidal composition for preparation of same SUMITOMO CHEMICAL CO (JP) 2006-07-05 EP disclosed
US-5872143-A 2,4-DIOXO-1-(2-PROPYNYL)IMIDAZOLIDIN-3-YLMETHYL CHRYSANTHEMATE (IMIPROTHRIN) MIXTURE FOR CONTROLLING COCKROACHES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-16 US disclosed