SCHEMBL11040367

SCHEMBL11040367

CCOc1cc2c(cc1OC)CC(N)=NC=C2

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
KDM4E B2RXH2 2/20 0.40
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
BRD4 O60885 1/20 0.39
PDE4D Q08499 3/20 0.38
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
DPP4 P27487 2/20 0.36
CYP3A4 P08684 1/20 0.36
LMNA P02545 1/20 0.36
ENPP1 P22413 1/20 0.35
TSHR P16473 2/20 0.35
BPTF Q12830 1/20 0.35
ALDH1A1 P00352 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL11057303 1.00 MAPT (0.40) MAPTKDM4EGAAMAPK1BRD4
Hydrochloric Acid SCHEMBL11051850 0.99 MAPT (0.42) MAPTKDM4EGAAMAPK1BRD4
Hydrochloric Acid SCHEMBL11059748 0.99 MAPT (0.42) MAPTKDM4EGAAMAPK1BRD4
Hydrochloric Acid SCHEMBL11040765 0.93 TSHR (0.36) MAPTKDM4EGAAMAPK1PDE4D
SCHEMBL11041640 0.90 BRD4 (0.45) MAPTKDM4EGAAMAPK1BRD4
Hydrochloric Acid SCHEMBL11040043 0.89 BRD4 (0.44) MAPTKDM4EGAAMAPK1BRD4
SCHEMBL11039717 0.82 BRD4 (0.41) MAPTKDM4EGAAMAPK1BRD4
Hydrochloric Acid SCHEMBL11038881 0.79 BRD4 (0.38) MAPTGAABRD4CYP3A4
Hydrochloric Acid SCHEMBL11042874 0.78 BRD4 (0.38) MAPTBRD4CYP3A4ALDH1A1MEN1
Hydrochloric Acid SCHEMBL11038894 0.78 MAOA (0.38) MAPTBRD4CYP3A4LMNATSHR

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
EP-0116444-A2 Improvements in or relating to benzazepine derivatives ELI LILLY AND COMPANY (US) 1984-08-22 EP claimed