SCHEMBL11266023

SCHEMBL11266023

CCCCOCCNc1ncc(N)c(O)n1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 19/20 0.36
TYRO3 Q06418 15/20 0.36
GAS6 Q14393 14/20 0.36
FLT3 P36888 13/20 0.36
AXL P30530 4/20 0.34

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
SCHEMBL11267279 0.92 KCNH3 (0.33) MERTKTYRO3GAS6FLT3AXL
SCHEMBL11396125 0.87 MERTK (0.39) MERTK
SCHEMBL10996367 0.86 TLR8 (0.43) MERTKTYRO3GAS6FLT3AXL
SCHEMBL11432081 0.85 TSHR (0.43) MERTKTYRO3GAS6FLT3
SCHEMBL11002056 0.83 KMT2A (0.43) MERTKTYRO3GAS6FLT3AXL
SCHEMBL10998571 0.83 KMT2A (0.43) MERTKTYRO3GAS6FLT3AXL
SCHEMBL10998512 0.82 MAPT (0.37) MERTKTYRO3GAS6FLT3AXL
SCHEMBL11158821 0.81 P2RX3 (0.42) MERTKTYRO3AXL
SCHEMBL11236452 0.79 KCNH3 (0.43) MERTKTYRO3GAS6
SCHEMBL11000318 0.76 CYP1A2 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0016374-B1 PENICILLINS, THEIR SALTS, PROCESS FOR THEIR PREPARATION AND THERAPEUTIC AGENTS CONTAINING THESE COMPOUNDS Dr. Karl Thomae GmbH (DE) 1982-03-03 EP disclosed
US-4289775-A BACTERICIDAL ANTIBIOTICS KARL THOMAE GMBH (DE) 1981-09-15 US disclosed
EP-0016374-A1 Penicillins, their salts, process for their preparation and therapeutic agents containing these compounds Dr. Karl Thomae GmbH (DE) 1980-10-01 EP disclosed