SCHEMBL27728541

SCHEMBL27728541

O=C(O)N1CCCC(n2cnc(-c3ccccc3F)c2)C1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 4/20 0.43
KDM4C Q9H3R0 4/20 0.43
KDM2A Q9Y2K7 3/20 0.43
KDM6B O15054 2/20 0.43
KDM5C P41229 2/20 0.43
KDM3A Q9Y4C1 1/20 0.43
POLB P06746 1/20 0.41
ALOX5AP P20292 2/20 0.41
FEN1 P39748 2/20 0.41
KDM5A P29375 1/20 0.39
KDM5B Q9UGL1 1/20 0.39
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
PROKR1 Q8TCW9 1/20 0.39
USP19 O94966 4/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 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
SCHEMBL27728466 0.85 DRD2 (0.51) KDM4AKDM4CKDM2AKDM6BKDM5C
SCHEMBL28769966 0.82 KDM2B (0.41) KDM4AKDM4CKDM2AKDM6BKDM5C
SCHEMBL27708035 0.82 KDM2B (0.41) KDM4AKDM4CKDM2AKDM6BKDM5C
SCHEMBL28774040 0.82 KDM2B (0.41) KDM4AKDM4CKDM2AKDM6BKDM5C
SCHEMBL27728545 0.81 SCD (0.41) KDM4AKDM4CKDM2AKDM6BKDM5C
SCHEMBL27728464 0.78 KDM2B (0.44) KDM4AKDM4CKDM2AKDM6BKDM5C
SCHEMBL410537 0.78 MEN1 (0.47) POLBALOX5APFEN1KMT2AMEN1
SCHEMBL27710693 0.78 KDM4C (0.39) KDM4AKDM4CKDM2AKDM6BKDM5C
SCHEMBL27860541 0.78 KDM4C (0.39) KDM4AKDM4CKDM2AKDM6BKDM5C
SCHEMBL27707947 0.78 ATM (0.51) KDM4AKDM4CKDM2AKDM6BKDM5C

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
CN-101228155-A Substituted * oxadiazole derivatives as positive allosteric modulators of metabotropic glutamate receptors ADDEX PHARMACEUTICALS SA (CH) 2008-07-23 CN disclosed