SCHEMBL7439341

SCHEMBL7439341

CCC1C(C)=NN=C(c2cccc(F)c2)c2cc(OC)c(OC)cc21

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.72
CHRM1 P11229 1/20 0.72
PDE4A P27815 1/20 0.72
KMT2A Q03164 1/20 0.72
PDE4D Q08499 1/20 0.72
PDE3A Q14432 1/20 0.72
PDGFRB P09619 1/20 0.40
PDGFRA P16234 1/20 0.40
MAPK10 P53779 1/20 0.39
PDE4B Q07343 3/20 0.38
HTR2C P28335 1/20 0.38
FYN P06241 2/20 0.37
KIT P10721 1/20 0.36
DPP4 P27487 1/20 0.36
GRM5 P41594 1/20 0.35
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
AHR P35869 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL7432689 0.87 MEN1 (0.77) MEN1CHRM1PDE4AKMT2APDE4D
Tofisopam SCHEMBL8086894 0.84 KMT2A (1.00) MEN1CHRM1PDE4AKMT2APDE4D
Dextofisopam SCHEMBL8086913 0.84 KMT2A (1.00) MEN1CHRM1PDE4AKMT2APDE4D
Tofisopam SCHEMBL29832594 0.84 KMT2A (1.00) MEN1CHRM1PDE4AKMT2APDE4D
Tofisopam SCHEMBL4585183 0.84 KMT2A (1.00) MEN1CHRM1PDE4AKMT2APDE4D
Dextofisopam SCHEMBL29376877 0.84 KMT2A (1.00) MEN1CHRM1PDE4AKMT2APDE4D
Dextofisopam SCHEMBL236796 0.84 KMT2A (1.00) MEN1CHRM1PDE4AKMT2APDE4D
Tofisopam SCHEMBL43522 0.84 KMT2A (1.00) MEN1CHRM1PDE4AKMT2APDE4D
SCHEMBL14599857 0.82 MEN1 (0.86) MEN1CHRM1PDE4AKMT2APDE4D
SCHEMBL7438293 0.81 KMT2A (0.79) MEN1CHRM1PDE4AKMT2APDE4D

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
US-4322346-A 5H-2,3-Benzodiazepine derivatives KOROSI JENO 1982-03-30 US disclosed