SCHEMBL8639260

SCHEMBL8639260

CC(=O)c1cc(C(=O)N=C(N)N)ccc1-c1cccnc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 7/20 0.49
MKNK2 Q9HBH9 7/20 0.49
HTR7 P34969 8/20 0.45
HTR2B P41595 8/20 0.45
DRD2 P14416 1/20 0.43
ADRA1D P25100 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
CHEK2 O96017 1/20 0.42
SLC2A1 P11166 1/20 0.41

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
SCHEMBL8637967 0.81 KMO (0.59) MKNK1MKNK2SLC2A1
SCHEMBL7814937 0.79 KMO (0.63) MKNK1MKNK2CHEK2
SCHEMBL8639249 0.78 MKNK1 (0.47) MKNK1MKNK2SLC2A1
Hydrochloric Acid SCHEMBL27404908 0.78 KMO (0.61) MKNK1MKNK2CHEK2
Hydrochloric Acid SCHEMBL7823972 0.78 KMO (0.61) MKNK1MKNK2CHEK2
SCHEMBL7915997 0.77 SLC9A1 (0.48) MKNK1MKNK2HTR7HTR2BDRD2
SCHEMBL19229958 0.76 KMT2A (0.56) MKNK1MKNK2SLC2A1
SCHEMBL12367001 0.75 MKNK1 (0.43) MKNK1MKNK2HTR7HTR2BDRD2
Hydrochloric Acid SCHEMBL8645968 0.74 CSNK1A1 (0.48) HTR7HTR2BDRD2ADRA1DHTR2A
SCHEMBL12366593 0.73 MKNK1 (0.42) MKNK1MKNK2HTR7HTR2BCHEK2

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-5849775-A Substituted benzoylguanidines process for their preparation, their use as a medicament or diagnostic, and pharmaceutical containing them HOECHST AKTIENGESELLSCHAFT (DE) 1998-12-15 US disclosed
US-5679712-A ANTIARRHYTHMIA AGENTS, TREATMENT OF CARDIOVASCULAR, NERVOUS SYSTEM DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1997-10-21 US disclosed