SCHEMBL9214847

SCHEMBL9214847

N#CN/C(=N\CCc1ccc(Cl)cc1)c1ccncc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 4/20 0.45
HTR3E A5X5Y0 1/20 0.44
HTR3B O95264 1/20 0.44
HTR3A P46098 1/20 0.44
HTR3D Q70Z44 1/20 0.44
HTR3C Q8WXA8 1/20 0.44
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
MAPT P10636 1/20 0.39
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
HRH4 Q9H3N8 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MIF P14174 1/20 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
SCHEMBL9214851 1.00 NAMPT (0.45) NAMPTHTR3EHTR3BHTR3AHTR3D
SCHEMBL9211741 0.85 SMN1; SMN2 (0.54) NAMPTHTR3EHTR3BHTR3AHTR3D
SCHEMBL9211746 0.85 SMN1; SMN2 (0.54) NAMPTHTR3EHTR3BHTR3AHTR3D
SCHEMBL9212769 0.79 HTR1A (0.46) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9212779 0.79 HTR1A (0.46) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9218915 0.75 NAMPT (0.51) NAMPT
SCHEMBL9218918 0.75 NAMPT (0.51) NAMPT
SCHEMBL9214854 0.75 KDM4E (0.48) CYP2D6CYP2C19MAPTMEN1KMT2A
SCHEMBL6818442 0.75 HTR3E (0.51) NAMPTHTR3EHTR3BHTR3AHTR3D
SCHEMBL6377119 0.73 EPHX2 (0.48) NAMPTHRH4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0388528-B1 Carboximidamide derivatives KIRIN BREWERY (JP) 1995-09-27 EP claimed
US-5223508-A Hypotensive agents, vasodilators KIRIN BEER KABUSHIKI KAISHA (JP) 1993-06-29 US claimed
EP-0388528-A2 Carboximidamide derivatives KIRIN BEER KABUSHIKI KAISHA (JP) 1990-09-26 EP claimed
EP-0388528-B1 Carboximidamide derivatives KIRIN BREWERY (JP) 1995-09-27 EP disclosed
US-5272164-A Carboximidamide derivatives KIRIN BEER KABUSHIKI KAISHA (JP) 1993-12-21 US disclosed
US-5223508-A Hypotensive agents, vasodilators KIRIN BEER KABUSHIKI KAISHA (JP) 1993-06-29 US disclosed
US-5166347-A Hypotensive agents, cardiovascular disorders, antiischemic agents and anticoagulants KIRIN BEER KABUSHIKI KAISHA (JP) 1992-11-24 US disclosed
EP-0388528-A2 Carboximidamide derivatives KIRIN BEER KABUSHIKI KAISHA (JP) 1990-09-26 EP disclosed