SCHEMBL7433445

SCHEMBL7433445

CCC1C(C)=NN=C(c2ccc(OC)c(OC)c2)c2cc(Cl)ccc21

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.76
MEN1 O00255 2/20 0.76
CHRM1 P11229 1/20 0.76
PDE4A P27815 1/20 0.76
PDE4D Q08499 1/20 0.76
PDE3A Q14432 1/20 0.76
TSHR P16473 4/20 0.39
LMNA P02545 3/20 0.39
MAPK1 P28482 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HSD17B10 Q99714 2/20 0.39
CASP1 P29466 1/20 0.39
ALDH1A1 P00352 4/20 0.38
HPGD P15428 3/20 0.38
KDM4E B2RXH2 2/20 0.38
SMN1; SMN2 Q16637 6/20 0.38
MAPT P10636 3/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 2/20 0.38
POLB P06746 1/20 0.37

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
SCHEMBL7444440 0.88 MEN1 (0.80) KMT2AMEN1CHRM1PDE4APDE4D
Tofisopam SCHEMBL29832594 0.87 KMT2A (1.00) KMT2AMEN1CHRM1PDE4APDE4D
Dextofisopam SCHEMBL29376877 0.87 KMT2A (1.00) KMT2AMEN1CHRM1PDE4APDE4D
Dextofisopam SCHEMBL236796 0.87 KMT2A (1.00) KMT2AMEN1CHRM1PDE4APDE4D
Levotofisopam SCHEMBL5431173 0.87 KMT2A (1.00) KMT2AMEN1CHRM1PDE4APDE4D
Tofisopam SCHEMBL4585183 0.87 KMT2A (1.00) KMT2AMEN1CHRM1PDE4APDE4D
Tofisopam SCHEMBL8086894 0.87 KMT2A (1.00) KMT2AMEN1CHRM1PDE4APDE4D
Dextofisopam SCHEMBL8086913 0.87 KMT2A (1.00) KMT2AMEN1CHRM1PDE4APDE4D
Tofisopam SCHEMBL43522 0.87 KMT2A (1.00) KMT2AMEN1CHRM1PDE4APDE4D
SCHEMBL7434144 0.84 KMT2A (0.86) KMT2AMEN1CHRM1PDE4APDE4D

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