SCHEMBL7437412

SCHEMBL7437412

CCC1C(C)=NN=C(c2ccccc2Cl)c2cc(OC)c(OC)cc21

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.66
KMT2A Q03164 3/20 0.66
CHRM1 P11229 1/20 0.66
PDE4A P27815 1/20 0.66
PDE4D Q08499 1/20 0.66
PDE3A Q14432 1/20 0.66
SMN1; SMN2 Q16637 3/20 0.41
MAPT P10636 3/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
KLK7 P49862 1/20 0.36
KLK14 Q9P0G3 1/20 0.36
KLK5 Q9Y337 1/20 0.36

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
SCHEMBL5198155 0.90 MEN1 (0.69) MEN1KMT2ACHRM1PDE4APDE4D
SCHEMBL5425871 0.90 MEN1 (0.69) MEN1KMT2ACHRM1PDE4APDE4D
SCHEMBL5424934 0.90 MEN1 (0.69) MEN1KMT2ACHRM1PDE4APDE4D
SCHEMBL7441797 0.89 MEN1 (0.67) MEN1KMT2ACHRM1PDE4APDE4D
SCHEMBL7432689 0.85 MEN1 (0.77) MEN1KMT2ACHRM1PDE4APDE4D
SCHEMBL9429934 0.84 MEN1 (0.45) MEN1KMT2ACHRM1PDE4APDE4D
SCHEMBL5428125 0.83 MEN1 (0.60) MEN1KMT2ACHRM1PDE4APDE4D
SCHEMBL5431277 0.83 MEN1 (0.60) MEN1KMT2ACHRM1PDE4APDE4D
SCHEMBL7412414 0.83 MEN1 (0.60) MEN1KMT2ACHRM1PDE4APDE4D
Tofisopam SCHEMBL4585183 0.80 KMT2A (1.00) MEN1KMT2ACHRM1PDE4APDE4D

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