SCHEMBL9507735

SCHEMBL9507735

CC1(C)OC2CCCCC2N1C(=O)C(Cl)Cl

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL9510269 0.97
SCHEMBL9442563 0.68
SCHEMBL1246931 0.66
SCHEMBL9815595 0.64
SCHEMBL3640945 0.64 MEN1 (0.30) ALDH1A1
SCHEMBL9509856 0.61 MEN1 (0.50) ALDH1A1
SCHEMBL11282748 0.61 DPP7 (0.46)
SCHEMBL8429253 0.60 SMN1; SMN2 (0.34) ALDH1A1
SCHEMBL8429251 0.60 SMN1; SMN2 (0.34) ALDH1A1
SCHEMBL167473 0.60 SMN1; SMN2 (0.34) ALDH1A1

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-0298680-B1 HERBICIDAL COMPOSITIONS OF ACYLATED 1,3-DICARBONYL HERBICIDES AND ANTIDOTES THEREFOR ZENECA INC. (US) 1993-09-15 EP disclosed
EP-0298680-A2 Herbicidal compositions of acylated 1,3-dicarbonyl herbicides and antidotes therefor ZENECA INC. (US) 1989-01-11 EP disclosed