SCHEMBL7862948

SCHEMBL7862948

Brc1cnc(-c2cncnc2)s1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.50
ATM Q13315 1/20 0.33
DYRK1A Q13627 1/20 0.32
DYRK1B Q9Y463 1/20 0.32
CYP2A6 P11509 1/20 0.31
HPGDS O60760 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
KDR P35968 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
SCHEMBL256074 0.78 SNCA (0.52) SNCAHDAC8KDR
SCHEMBL8031390 0.76 HPGDS (0.54) SNCACYP2A6HPGDS
SCHEMBL928439 0.74 SNCA (0.55) SNCAHPGDSKDR
SCHEMBL13142474 0.71 SNCA (0.66) SNCAKDR
SCHEMBL22466129 0.71 SNCA (0.56) SNCAHDAC8
SCHEMBL25382795 0.71 SNCA (0.56) SNCAHDAC8
SCHEMBL5561901 0.71 SNCA (0.51) SNCAHPGDSKDR
SCHEMBL20641446 0.71 SNCA (0.56) SNCA
SCHEMBL10013471 0.71 SNCA (0.51) SNCAHDAC8
SCHEMBL14157145 0.71 SNCA (0.66) SNCA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1343215-A 6-O-substituted macrolides with antibacterial activity ABBOTT LAB (US) 2002-04-03 CN disclosed
EP-1161438-A1 6-O-SUBSTITUTED MACROLIDES HAVING ANTIBACTERIAL ACTIVITY ABBOTT LABORATORIES (US) 2001-12-12 EP disclosed
WO-2000055168-A1 6-O-SUBSTITUTED MACROLIDES HAVING ANTIBACTERIAL ACTIVITY ABBOTT LABORATORIES (US) 2000-09-21 WO disclosed
US-6054435-A 6-O-substituted macrolides having antibacterial activity ABBOTT LABORATORIES (US) 2000-04-25 US disclosed