SCHEMBL9867116

SCHEMBL9867116

CC(C)(C)C#CC=CCON

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
ADRA2A P08913 1/20 0.32
CYP2D6 P10635 1/20 0.32
SLC6A2 P23975 1/20 0.32
SQLE Q14534 1/20 0.32
SIGMAR1 Q99720 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
SCHEMBL2770183 0.75 LMNA (0.37) LMNAADRA2ACYP2D6SLC6A2SQLE
SCHEMBL4439415 0.72 KDM4E (0.31) LMNA
SCHEMBL5168923 0.71 LMNA (0.33) LMNAADRA2ACYP2D6SLC6A2SQLE
SCHEMBL4432850 0.70 LMNA (0.34) LMNAADRA2ACYP2D6SLC6A2SQLE
SCHEMBL4432851 0.70 LMNA (0.34) LMNAADRA2ACYP2D6SLC6A2SQLE
SCHEMBL3142339 0.70 LMNA (0.34) LMNAADRA2ACYP2D6SLC6A2SQLE
SCHEMBL9633566 0.70 LMNA (0.34) LMNAADRA2ACYP2D6SLC6A2SQLE
SCHEMBL3142336 0.70 LMNA (0.34) LMNAADRA2ACYP2D6SLC6A2SQLE
SCHEMBL28677813 0.70 LMNA (0.34) LMNAADRA2ACYP2D6SLC6A2SQLE
Hydrochloric Acid SCHEMBL9052386 0.70 LMNA (0.32) LMNAADRA2ACYP2D6SLC6A2SQLE

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5036158-A Intermediate compounds for an insecticidal and acaricidal pyrazole compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-07-30 US disclosed
US-5021446-A Pyrazole compounds, insecticidal and acaricidal compositions and use SUMITOMO CHEMICAL COMPANY (JP) 1991-06-04 US disclosed
EP-0341048-A1 A pyrazole compound and its production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-11-08 EP disclosed