SCHEMBL11087674

SCHEMBL11087674

CCCCNc1ncc(C(=O)O)c(O)n1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.51
KDM6B O15054 1/20 0.49
KDM4C Q9H3R0 1/20 0.49
MERTK Q12866 16/20 0.48
TYRO3 Q06418 14/20 0.48
GAS6 Q14393 12/20 0.48
FLT3 P36888 9/20 0.48
AXL P30530 4/20 0.47
HCAR3 P49019 2/20 0.47

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
SCHEMBL11081631 0.96 HCAR3 (0.48) MAPK8KDM6BKDM4CMERTKTYRO3
SCHEMBL11081740 0.94 HCAR3 (0.47) MAPK8KDM6BKDM4CMERTKTYRO3
SCHEMBL11082898 0.94 HCAR3 (0.47) MAPK8KDM6BKDM4CMERTKTYRO3
SCHEMBL11083328 0.91 KDM6B (0.47) MAPK8KDM6BKDM4CMERTKTYRO3
SCHEMBL25268627 0.85 MAPK8 (0.51) MAPK8KDM6BKDM4CMERTKTYRO3
SCHEMBL11083556 0.85 MERTK (0.47) MAPK8MERTKTYRO3GAS6FLT3
SCHEMBL11083131 0.83 RAB9A (0.51) MERTKTYRO3GAS6FLT3AXL
SCHEMBL11086984 0.82 PKM (0.36) MAPK8KDM6BKDM4CMERTKTYRO3
SCHEMBL11091563 0.81 HCAR3 (0.48) MERTKTYRO3GAS6HCAR3
SCHEMBL11087833 0.81 ASPH (0.55) KDM6BKDM4C

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
US-4447422-A Penicillins and compositions containing them BEECHAM GROUP P.1.C. (GB) 1984-05-08 US disclosed
EP-0067610-A1 Penicillins, a process for their preparation and compositions containing them BEECHAM GROUP PLC (GB) 1982-12-22 EP disclosed