SCHEMBL8804337

SCHEMBL8804337

Cc1ccc(C(=O)N=C(N)N)cc1N1CCCC1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 2/20 0.63
HTR7 P34969 5/20 0.45
HTR2B P41595 5/20 0.45
DRD2 P14416 1/20 0.45
ADRA1D P25100 1/20 0.45
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45
ADRA1A P35348 1/20 0.45
ADRA1B P35368 1/20 0.45

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
SCHEMBL8803284 0.99 SLC9A1 (0.65) SLC9A1HTR7HTR2BDRD2ADRA1D
SCHEMBL3341824 0.83 ALDH1A1 (0.55)
SCHEMBL8804089 0.83 SLC9A1 (0.60) SLC9A1HTR7HTR2BDRD2ADRA1D
SCHEMBL8804714 0.82 SLC9A1 (0.62) SLC9A1HTR7HTR2BDRD2ADRA1D
Hydrochloric Acid SCHEMBL9402429 0.79 SLC9A1 (0.65) SLC9A1HTR7HTR2B
SCHEMBL23792954 0.79 GAA (0.60)
SCHEMBL7825554 0.78 SLC9A1 (0.55) SLC9A1HTR7HTR2BDRD2ADRA1D
SCHEMBL29357040 0.78 SLC9A1 (1.00) SLC9A1
SCHEMBL3906519 0.78 SLC9A1 (1.00) SLC9A1
SCHEMBL15392283 0.77 GAA (0.62)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0556672-B1 Amino-substituted benzoylguanidines with antiarrhythmic properties HOECHST AG (DE) 1997-08-06 EP claimed
US-5364868-A Amino-substituted benzoylguanidines, process for their preparation, their use as a medicament and medicament containing them HOECHST AKTIENGESELLSCHAFT (DE) 1994-11-15 US claimed
CN-1075960-A Amino benzoyl guanidine, its preparation method that replaces is as the purposes and the medicament that contains it of medicine HOECHST AG (DE) 1993-09-08 CN claimed
EP-0556672-A1 Amino-substituted benzoylguanidines with antiarrhythmic properties HOECHST AKTIENGESELLSCHAFT (DE) 1993-08-25 EP claimed
CN-1036267-C Amino-subst.-benzoyl guanidines, a process for production thereof, use as drug thereof and drug containing it HOECHST AG (DE) 1997-10-29 CN disclosed
EP-0556672-B1 Amino-substituted benzoylguanidines with antiarrhythmic properties HOECHST AG (DE) 1997-08-06 EP disclosed
US-5364868-A Amino-substituted benzoylguanidines, process for their preparation, their use as a medicament and medicament containing them HOECHST AKTIENGESELLSCHAFT (DE) 1994-11-15 US disclosed
CN-1075960-A Amino benzoyl guanidine, its preparation method that replaces is as the purposes and the medicament that contains it of medicine HOECHST AG (DE) 1993-09-08 CN disclosed
EP-0556672-A1 Amino-substituted benzoylguanidines with antiarrhythmic properties HOECHST AKTIENGESELLSCHAFT (DE) 1993-08-25 EP disclosed