SCHEMBL7360169

SCHEMBL7360169

N#CN=C(Nc1cccnc1)NC(c1ccccc1)C1CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.41
NAMPT P43490 4/20 0.40
EPHX2 P34913 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
LMNA P02545 2/20 0.40
GAA P10253 1/20 0.40
FPR2 P25090 1/20 0.40
KMT2A Q03164 3/20 0.39
ABCC9 O60706 2/20 0.39
ABCC8 Q09428 2/20 0.39
KCNJ11 Q14654 2/20 0.39
KCNJ8 Q15842 2/20 0.39
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
PKM P14618 1/20 0.39
CFTR P13569 1/20 0.39
GOPC Q9HD26 1/20 0.39

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
SCHEMBL8775157 1.00 P2RX7 (0.41) P2RX7NAMPTEPHX2NPC1RAB9A
SCHEMBL8775041 0.81 KMT2A (0.47) NAMPTEPHX2NPC1RAB9ALMNA
SCHEMBL7347337 0.81 KMT2A (0.47) NAMPTEPHX2NPC1RAB9ALMNA
SCHEMBL7347332 0.81 KMT2A (0.47) NAMPTEPHX2NPC1RAB9ALMNA
SCHEMBL7347329 0.81 KMT2A (0.47) NAMPTEPHX2NPC1RAB9ALMNA
SCHEMBL7348948 0.80 EPHX2 (0.47) P2RX7NAMPTEPHX2NPC1RAB9A
SCHEMBL7348937 0.80 EPHX2 (0.47) P2RX7NAMPTEPHX2NPC1RAB9A
SCHEMBL7348934 0.80 EPHX2 (0.47) P2RX7NAMPTEPHX2NPC1RAB9A
SCHEMBL11156357 0.79 RAB9A (0.57) P2RX7NAMPTNPC1RAB9ALMNA
SCHEMBL8775014 0.79 KMT2A (0.47) NAMPTEPHX2NPC1RAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0655057-B1 CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS UPJOHN CO (US) 1997-09-17 EP claimed
US-5567722-A DIURETICS THE UPJOHN COMPANY (US) 1996-10-22 US claimed
EP-0655057-A1 CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS. UPJOHN CO (US) 1995-05-31 EP claimed
WO-1994004499-A1 CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS THE UPJOHN COMPANY (US) 1994-03-03 WO claimed
WO-1994004500-A1 CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS THE UPJOHN COMPANY (US) 1994-03-03 WO claimed
EP-0655057-B1 CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS UPJOHN CO (US) 1997-09-17 EP disclosed
US-5567722-A DIURETICS THE UPJOHN COMPANY (US) 1996-10-22 US disclosed
EP-0655057-A1 CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS. UPJOHN CO (US) 1995-05-31 EP disclosed
WO-1994004499-A1 CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS THE UPJOHN COMPANY (US) 1994-03-03 WO disclosed
WO-1994004500-A1 CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS THE UPJOHN COMPANY (US) 1994-03-03 WO disclosed