SCHEMBL5209079

SCHEMBL5209079

[CH2]CCCC(=O)N(C)CC

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
ALDH1A1 P00352 2/20 0.43
ACHE P22303 5/20 0.35
BCHE P06276 4/20 0.35
KDM5A P29375 2/20 0.34
KDM4C Q9H3R0 2/20 0.34
EPHX2 P34913 2/20 0.34
CNR1 P21554 1/20 0.34
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA4 P43681 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL7557868 0.91 LMNA (0.41) LMNAALDH1A1ACHEBCHEKDM5A
SCHEMBL7550982 0.91 LMNA (0.41) LMNAALDH1A1ACHEBCHEKDM5A
SCHEMBL7557928 0.91 LMNA (0.41) LMNAALDH1A1ACHEBCHEKDM5A
SCHEMBL7558930 0.91 LMNA (0.41) LMNAALDH1A1ACHEBCHEKDM5A
SCHEMBL5206046 0.86
SCHEMBL11782469 0.83 LMNA (0.50) LMNAALDH1A1ACHEBCHEKDM5A
SCHEMBL5206157 0.83 ALDH1A1 (0.45) LMNAALDH1A1ACHEBCHEKDM5A
SCHEMBL8046344 0.81 ALDH1A1 (0.65) LMNAALDH1A1KDM5AKDM4CEPHX2
SCHEMBL5204615 0.81 EPHX2 (0.49) ALDH1A1ACHEBCHEKDM5AKDM4C
SCHEMBL497604 0.79 LMNA (0.73) LMNAALDH1A1NPC1RAB9A

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
EP-0958292-B1 4-(3-HETEROCYCLYL-1-BENZOYL)PYRAZOLES AND THEIR USE AS HERBICIDES BASF AG (DE) 2007-01-03 EP disclosed
US-6165944-A 4-(3-heterocyclyl-1-benzoyl) pyrazoles and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 2000-12-26 US disclosed
CN-1250447-A 4-(3-heterocyclyl-1-benzoyl) pyrazoles and their use as herbicides BASF AG (DE) 2000-04-12 CN disclosed