SCHEMBL8670351

SCHEMBL8670351

CC(=O)N1CCN(n2c(C(F)(F)F)nc3c(NC(=O)c4c(Cl)cccc4Cl)c(C=C=O)ccc32)CC1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
TYK2 P29597 1/20 0.33
PTGES O14684 1/20 0.32
CDK14 O94921 4/20 0.32
CCNY Q8ND76 4/20 0.32
PDE4B Q07343 2/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
EGFR P00533 1/20 0.31
RORC P51449 1/20 0.31
RAB9A P51151 2/20 0.31
CNR2 P34972 2/20 0.31
PDE4A P27815 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
NPC1 O15118 1/20 0.30
KMT2A Q03164 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL8597843 0.91 TYK2 (0.35) MAPTTYK2PTGESPDE4BRORC
SCHEMBL8598885 0.77 TYK2 (0.44) TYK2PTGESPDE4BRORCRAB9A
SCHEMBL8596977 0.75 TYK2 (0.38) KDM4EALDH1A1TYK2PDE4BRORC
SCHEMBL8597247 0.75 LCK (0.37) TYK2PTGESPDE4BLMNARORC
Hydrochloric Acid SCHEMBL8600677 0.74 TYK2 (0.37) KDM4EALDH1A1TYK2PDE4BRORC
SCHEMBL8670347 0.68 MAPT (0.48) KDM4EALDH1A1MAPTPTGES
SCHEMBL8670346 0.68 PTGES (0.36) MAPTTYK2PTGESCDK14CCNY
SCHEMBL8670342 0.67 MAPK8 (0.36) KDM4EALDH1A1MAPTTYK2PTGES
SCHEMBL8601990 0.65 KMT2A (0.40) MAPTTYK2PTGESPDE4BLMNA
SCHEMBL8598365 0.62 TYK2 (0.44) TYK2PTGESPDE4BSMN1; SMN2PDE4A

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-0863881-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE IN THE PREVENTION AND/OR THE TREATMENT OF BONE DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-09-16 EP disclosed
WO-1997010219-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE IN THE PREVENTION AND/OR THE TREATMENT OF BONE DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-03-20 WO disclosed