SCHEMBL9855576

SCHEMBL9855576

CCCCCCCCCCCCCCCCCCOc1cn(Cc2ccccc2)c(COCCCN(C)C)cc1=O

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRA P10827 3/20 0.42
THRB P10828 2/20 0.39
HRH1 P35367 1/20 0.39
EHMT2 Q96KQ7 1/20 0.38
TYR P14679 2/20 0.38

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
Hydrochloric Acid SCHEMBL8120665 0.99 THRA (0.41) THRATHRBHRH1EHMT2TYR
SCHEMBL9855823 0.91 THRA (0.39) THRATHRB
SCHEMBL9855915 0.91 THRB (0.37) THRATHRB
Hydrochloric Acid SCHEMBL9290835 0.90 THRA (0.38) THRATHRB
Hydrochloric Acid SCHEMBL8128505 0.90 THRB (0.37) THRATHRB
SCHEMBL8128958 0.90 THRA (0.39) THRATHRB
Hydrochloric Acid SCHEMBL9291092 0.89 THRA (0.39) THRATHRB
SCHEMBL9291234 0.87 THRA (0.39) THRATHRBHRH1
SCHEMBL9855958 0.86 THRA (0.42) THRATHRB
SCHEMBL8135165 0.86 THRA (0.41) THRATHRBTYR

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-0427765-A1 ALKOXY-4(1H)-PYRIDONE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USE AS DRUGS GÖDECKE AKTIENGESELLSCHAFT (DE) 1991-05-22 EP disclosed
WO-1990001477-A1 ALKOXY-4(1H)-PYRIDONE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USE AS DRUGS Gödecke Aktiengesellschaft (DE) 1990-02-22 WO disclosed
EP-0354495-A1 Alkoxy-4(1H)-pyridone derivatives, process for their preparation and their pharmaceutical use GÖDECKE AKTIENGESELLSCHAFT (DE) 1990-02-14 EP disclosed