SCHEMBL3875010

SCHEMBL3875010

O=C(c1ccccc1F)N1CCCC(n2cnc(-c3ccc(F)c(F)c3)c2)C1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 4/20 0.45
FEN1 P39748 4/20 0.45
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
GRM5 P41594 1/20 0.40
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
POLB P06746 1/20 0.40
KDM2A Q9Y2K7 3/20 0.39
KDM6B O15054 2/20 0.39
KDM4A O75164 2/20 0.39
KDM5C P41229 2/20 0.39
KDM4C Q9H3R0 2/20 0.39
KDM3A Q9Y4C1 1/20 0.39

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
SCHEMBL410537 0.91 MEN1 (0.47) ALOX5APFEN1MEN1KMT2AKDM4E
SCHEMBL3885641 0.80 MEN1 (0.43) ALOX5APFEN1MEN1KMT2AGRM5
SCHEMBL27728541 0.77 KDM4A (0.43) ALOX5APFEN1MEN1KMT2ARAB9A
SCHEMBL412186 0.77 GRM5 (0.53) MEN1KMT2AGRM5KDM4EALDH1A1
SCHEMBL3876005 0.77 GRM5 (0.53) MEN1KMT2AGRM5KDM4EALDH1A1
SCHEMBL27728460 0.77 PDE2A (0.49) MEN1KMT2AKDM4EALDH1A1
SCHEMBL27707947 0.77 ATM (0.51) MEN1KMT2AGRM5KDM4EALDH1A1
SCHEMBL27670316 0.76 GRM5 (0.41) MEN1KMT2AGRM5MAPTRAB9A
SCHEMBL27728466 0.75 DRD2 (0.51) KDM4EALDH1A1RAB9AKDM2AKDM6B
SCHEMBL28774040 0.75 KDM2B (0.41) MEN1KMT2AGRM5KDM4EPOLB

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-2030970-A1 Allosteric modulators of metabotropic glutamate receptors ADDEX Pharma S.A. (CH) 2009-03-04 EP claimed
EP-1685105-B1 ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA SA (CH) 2008-10-15 EP claimed