SCHEMBL6686815

SCHEMBL6686815

CCC1(CC(=O)C(=O)OC)CCCc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 10/20 0.41
KDM5A P29375 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
KDM5B Q9UGL1 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
AKR1B1 P15121 1/20 0.38
CHRNA7 P36544 1/20 0.38

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
SCHEMBL6689892 0.85 NR3C1 (0.43) NR3C1KDM5AKDM4CKDM5B
SCHEMBL15673547 0.82 NR3C1 (0.44) NR3C1KDM5AKDM4CKDM5BKMT2A
SCHEMBL6684521 0.82 KDM5A (0.47) NR3C1KDM5AKDM4CKDM5BKMT2A
SCHEMBL6688420 0.82 HDAC9 (0.41) NR3C1
SCHEMBL808956 0.79 NR3C1 (0.51) NR3C1
SCHEMBL5138499 0.79 KDM1A (0.50) NR3C1KMT2AMEN1AKR1B1
SCHEMBL6925659 0.75 NR3C1 (0.40) NR3C1KDM5AKDM4CKDM5B
SCHEMBL24483733 0.74 KMT2A (0.41) KDM5AKDM4CKDM5BKMT2AMEN1
SCHEMBL5547903 0.73 SIGMAR1 (0.47) NR3C1KMT2AMEN1
SCHEMBL23385700 0.73 KDM1A (0.49) NR3C1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004071389-A2 NON-STEROIDAL INFALMMATION INHIBITORS GLAXO GROUP LIMITED (GB) 2004-08-26 WO disclosed